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MASS SPECTRAL CORRELATIONS 2ND EDITION (Oxford University Press, out of print) Edited by Fred W McLafferty & Rengachari Venkataraghavan Digitized by Arita Laboratory (metabolome.jp)

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## MASS SPECTRAL CORRELATIONS 2ND EDITION
## OXFORD UNIVERSITY PRESS
## EDITED BY FRED W MCLAFFERTY AND RENGACHARI VENKATARAGHAVAN
## ISBN13: 978-0-8412-0702-8
12	C	12.0000 	
13	CH	13.0018 	
14	CH2	14.0156 	
	N 	14.0031 	
15	CH3	15.0235 	CH3-Y*
16	O	15.9949 	
	H2N 	16.0187 	
17	HO	17.0027 	
	H3N	17.0265 	
18	H2O	18.0106 	
19	F	18.9984 	
	H3O	19.0184 	
24	C2	24.0000 	highly unsatd hc
	B2H2	24.0343	
25	C2H	25.0078 	highly unsatd hc
	B2H3	25.0421 		
26	C2H2	26.0156 	ar/unsatd hc	
	CN 	26.0031 	"NC-R, RCHN2"	
	B2H4	26.0499 		
27	C2H3	27.0235 	"CH2=CH-Y*, other hc"	
	CH4B	27.0406 	"CH3BH-, higher boron alkyls"	
	B2H5	27.0577 		
28	N2	28.0061 		
	C2H4	28.0313 	hc	
	CHI	28.0187 	"aziridines, (CH3)2N-, other amines"	
	CO	27.9949 	lactones	
29	CHO	29.0027 	-CH2O-	
	C2H5	29.0391 		
	CH3N 	29.0265 	"-CH2N(-)-, -CH2NH-"	
30	CH4N	30.0343 	"-CH2NH-: CH2 50%; C=O 30%, CH2 30%; H2NCH2-: CH2 70%, CH 17%"	
	CH2O	30.0105 	"CH3O-, -CH2O-, HOCH2-"	
	NO	29.9979 	"-NO2, -N(-)NO, -O-NO"
	H2N2	30.0216 	
	H2Si	30.9921 	
31	CH3O	31.0184 	"HOCH2-: CH 45%, CH2 33%, C 13%; -CH2O-: CH2 47%, CH3 42%; C=O 61%; CH3O-: C=O 59% "
	CF	30.9984 	"F-C(-)2-: F, Cl F-ar-, F-C(-)= "
	HNO	31.0057 	-O-N(-)-
	CH5N	31.0421 	CH3NH-: C=O 35%
32	S	31.9721		
	O2	31.9898		
	CH4O	32.0262 	
33	CH5O	33.0340 	
	HS	32.9802 	
	CH2F	33.0140 	
	H2P	32.9894 	
34	H2S	33.9880 	
35	Cl	34.9688 	Cl: Y*
	H2NF	35.0171				
36	HCl	35.9766 				
37	C3H	37.0078 				
38	C3H2	38.0156 	unsatd hc			
	C2N	38.0030 	"arN, ar-N(-)-, ar-NH-"			
39	C3H3	39.0235 	"HC#CCH2-, ar "			
	C2HN	39.0108 	"arN, unsatd R-CN"			
40	C3H4	40.0313 	diunsatd/cyc hc			
	C2O	39.9949 	"ar(CO), R-CO-"			
	C2H2N	40.0186 	"arN, imines, unsatd amines"			
	CN2	40.0060 	arN2			
41	C3H5	41.0391 	"CH2=CHCH2-, other hc"			
	C2HO	41.0027 	"-CH2-CO-, -CH(-)-CO-, -C(-)2-CO-, ar-OH"			
	C2H3N	41.0265 	"arN, NC-CH2-, -CH2CH2N(-),@CH2CH(-)NH-"			
	CHN2	41.0138 	"arN2, arN-NH2"			
	CHN2	41.0138		"arN2, arN-NH"			
42	C2H2O	42.0105 	"-CH2-CO-: CH2 60%, CH3 15%; O 40%, CH2 30%; CH3-CO-: -O- 30%, CH2 20%, -N(-)- 15%, -NH- 12% -CH(-)-CO-, CH2CH(-)O-, -CH2CH2O-, =CH-CO-"	
	C3H6	42.0469 	"CH2=CH-CH2-, cycC3H5-, hc"
	C2H4N	42.0343 	"CH3N=CH-, arN, cycN, aziridinyl"	
	CH2N2	42.0216 	"arN2, H2N-arN, CH3N=N-"
	CNO	41.9979 	"-NH-CO-, -N(-)-CO-, HO-arN, OCN-"	
	N3	42.0090 	"-NH-N=N-, -N(-)N=N-"	
43	C2H3O	43.0184 	"CH3-CO-: -O- 28%, CH 19%, CH2 13%, -NH- 10%; -CH2-CO-: CH2 60%, CO 21%; -O- 53%, CH2 23%; -CH(OH)CH2-: CH2 67%; CH2 78%; -CH2CH2O-: CH2 65%, CH3 20%; CO 53%, CH2 25-%; -CH2C(-)2O-, -CH(CH3)O-, -CH2OCH2-"	
	C3H7	43.0547 		
	C2H5N	43.0421 	"cycN, -CH2CH2N(-)-, C2H5NH-, -CH2CH(-)NH-, -CH(CH3)N(-)-, -CH2CH2NH-, -CH2N(CH3)-"
	CHNO	43.0057 	"-NH-CO-, -N(-)-CO-, H2N-CO-"
	CH3N2	43.0295 	"arN-NH2, -N(-)N(-)CH2-, -N=NCH3, -N=NCH2-"	
	HN3	43.0168 		
	C2F 	42.9984 		
	CP	42.9738 		
44	C2H4O	44.0262 	"CH3-CO-: -NH- 32%, -O- 20%, N 17%; C2H5O-, HOCH2CH2-, -CH2CH2O-, HO-cyc, H-CO-CH2- "	
	C2H6N	44.0499 	"CH3CH(NH2)-, CH3NHCH2-: CH2 75%; -CH2NHCH2-: CH2 50%, CH 30%; CH2: CH2 30%; (CH3)2N-: -CH=, ar, C=O, -S-; cyc-CH2N(CH3)-, -CH2CH2NH-, -CH2CH(NH2)-, -CH2-CH2N(-)-, -CH2N(CH3)-, H2NCH2CH2-"	
	CH2NO 	44.0135 	"-NH-CO-: ar 30%, CH2 20%; N 22%, -NH- 17%, -O- 15%; H2N-CO-: CH2 35%, -NH- 20%, ar 15%; HO-arN, H-CO-NH-, -N(-)-CO-, ON-ar, ON-CH="
	CO2	43.9898 	"HO-CO-: CH 30%, ar 25%, CH2 25%; -O-CO-: CH3 55%; CH 28%, ar 20%, CH2 20%"
	CH4N2	44.0373 	"-N(CH3)N(-)-; -N(-)N(-)CH2-; CH3N=N-, -N-CH=N-, H2N-NHCH2-, H2N-arN, H2NC(-)=N-, cyc-CH2N(NH2)-"
	C2HF	44.0062 	
	N2O	44.0009 	 
	CS	43.9724 	   
45	C2H5O	45.0340 	"CH3OCH2-: CH 47%, CH2 28%; CH3CHOH-: CH2 62%, CH 28%, C=0 6%; -CH2OCH2-: CH2 76%, CH3 15%; CH2: CH2 55%; CH(CH3)O-: CH3 50%=, -O- 33%, CH2 42%, C=O 38%; -CH2CHOH-, HOCH2CH2-, HOC(-)2CH2-, HOCH2CH(-)-; CH3CH2O-, -CH2CH2O-, CH3CH(-)-O-"
	CHO2	44.9976 	"-CO-O-: CH2 40%, CH 15%, ar 15%; Si 39%+, CH2 28%-, CH3 25%; HOOC-: CH2 50%, CH 20%, ar 17%, C 8%; -OC(-)2O-, -OCH2O-, -OCH(-)O-"
	CHS	44.9799 	"arS; -SCH2-:CH2 45%, CH 25%; CH2 55%, CH 20%; ar-S-"
	C2H7N	45.0578 	"(C2H6N+ usually larger); (CH3)2N-: CH2 30%, C=O 25%, -C=15%; H2NCH2CH2-: CH2 70%, NH 5%, CH 5%; H2NCH(CH3)-, -CH(NH2)CH2-, CH3CH2NH-"
	CH3NO	45.0215	"H2N-CO-, -NH-CO-, ONCH-"
	C2H2F 	45.0140 	" CHF=CH-, CH3CF(-)-, -CF=CHF-"
	CH5N2	45.0452 	    
46	NO2	45.9928 	"nitrates, ar-NO2, R-ONO"
	CH2O2	46.0054 	
	C2H6O	46.0418 	
	CH2S	45.9880 	-CH2S-
	NS	45.9754 	S=N-
47	CH3S	46.9959 	"HSCH2-, -CH2S-, CH3S-"
	CH3O2	47.0133 	"-OCH(-)-, HO-CO-"
	CCl	46.9688 	
	C2H7O	47.0496 	"CH3O-Y*-CH3, Polyalcohols/eithers"
	C2H4F	47.0297 	CH3CHF-
	PO	46.9687 	
	CH4P	47.0051 	
	COF	46.9933 	F-CO-
	Fsi	47.9749 	
48	CH4S	48.0037 	"CH3S-: CH2 50%., CH 20%, C=O 8%; -CH2S-: CH2 35%, CH 12%, CH2 40%, CH 12%"
	CHCl	47.9766 	  
	H2NO2	48.0084 	"-ONO, -NO2"
	H2NS	47.9910 	
	CH4O2	48.0211 	
	OS	47.9673 			
	HOP	47.9765 			
49	C4H	49.0078 			
	CH2Cl	48.9844 	"ClCH2-: CH2 35%, CH 30%, C=O 10%; ClC(-)2-; ClCH(-)-: Cl 25%, CH3 20%, CH2 20%"	
	HOS	48.9751 	"O=S(-)-:CH2 35%, O 35%"		
	H2OP	48.9843 	"O=P(-)2-: CH3 40%, O 15%, S 15%"		
	H2FSi	48.9809 			
	NCl	48.9718 			
	CH2OF	49.0089 			
50	C4H2	50.0156 	ar		
	C3N	50.0030 	arN		
	CF2	49.9968 	-CF2-		
	CH3Cl	49.9923 	"ClCH2-: C=O 45%, -C=C- 45%"		
51	C4H3	51.0235 	ar		
	C3HN	51.0108 	"arN, ar-N(-)-"		
	CHF2	51.0046 	"CHF2-: CX2 35%, C=O 30%; -CF2-"		
	FS	50.9708 	
	HFP	50.9800 	
52	C3H2N	52.0186 	"arN, ar-NH2"
	C3O	51.9949 	"ar-CO-, ar(C=O), ar-O-"
	C4H4	52.0313 	"ar, unsatd hc"
	C2N2	52.0060 	arN2
53	C4H5   	53.0391 	polyunsatd hC
	C3HO	53.0027 	"ar(C=O), arO, ar-O-, cyc-CO-, cyc-O-"
	C3H3N	53.0265 	"arN, ar-NH2, cycN"
	C2HN2	53.0138 	"arN2, cycN2"
54	C4H6	54.0469 	
	C3H2O	54.0105 	"ar(CO), R-CO-"
	C3H4N	54.0343 	"NC-CH2CH2-, ar(NH), imines, -CH2CH2C(=NH)-"
	C2H2N2	54.0216 	arN2
	C2NO	53.9979 	arNO
	CN3	54.0090 	arN3
55	C4H7	55.0547 	"H2C=C(CH3)CH2-, CH3CH=CHCH2-, other hc"
	C3H3O	55.0184 	"cyc-CH2CH2-CO-: CH2 50%, CH 15%; CH2 40%, -O- 30%; CH2=CH-CO-, -CH=CH-CO-; -CH=CHCH2O-, HOCH2C#C-, ar-OCH3 "
	C3H5N	55.0421 	"substd/cyc amines, NC-CH2CH2-, CN-CH2CH2-, arN "
	C2HNO	55.0057 	"-CH2-CO-N(-)-, -CH2N(-)-CO-, OCN-CH2-, -NHCH(-)-CO-"
	C2H3N2	55.0295 	"arN2, arN-NHCH3, cyc/substd diamines"
	CHN3	55.0168 	arN3
56	C4H8 	56.0626 	"H-C4H8-Y*, H-C4H8-R-Y*, H-R-CH2C(CH3)=CH2, hc"
	C3H4O	56.0262 	substd/cyc ketones/ethers
	C3H6N	56.0499 	cyc/subst amines (cyc-CH2CH2CH(NH2)-)
	C2H2NO	56.0135 	"cyc/subst amides (-N(CH3)-CO-), OCN-CH2-, ar-NO"
	C2O2	55.9898 	"-CH2O-CO-, -CH2-CO-O-, -CO-CO-"
	C2H4N2	56.0373 	"arN2, C2H5N(-)N(-)- "
	CN2O	56.0009 	
	CH2N3	56.0246 	arN3
57	C3H5O	57.0340 	"-CH2CH2OCH2-: CH2 68%, OH 23%, CH2 72%, CH 18%; -CH2CH2-CO-: CH2 35%, -O- 20%, CH2 30%, -O- 20%; C2H5-CO-: CH2 33%, -O- 21%; -CH2CH2CH(OH)- (cycloalkanols), -CH(CH2OH)CH2-, cycO; -(CH2)3O-, CH3CH(-)-CO-"
	C4H9	57.0704 	
	C2HO2	56.9976 	"-CH2O-CO-: CH2 35%, CH3 27%; CH 30%; -CH2-CO-O: CH2 45%, CH3 18%; CH3 47%; -CO-CO-; -C(-)2O-CO-, cyc-CH(OH)-CO-, -C(-)2-CO-O-, cyc-CH(-COOH)-"
	C3H7N	57.0577 	"-(CH2)3N(-)-, -CH2CH2N(CH3)-, CH3N=CHCH2-, -(CH2)3NH-, -CH2CH2N(-)CH2-, -C(CH3)2N(-)-"
	C2H3NO	57.0214 	
	C2H5N2	57.0451 	  
	CHN2O	57.0087 	  
	CH3N3	57.0325 	
	C2H2P	56.9894 	
58	C3H8N	58.0656 	"(CH3)2NCH2-: CH2 65%, CH 20%; -CH2N(C2H5)-: CH3 50%; C=O 60%; cyc-CH2N(CH3)CH2-: CH2: CH2 50%; other cycN; C2H5NHCH2-, C2H5CH(NH2)-, (CH3)2C(NH2)-, CH3NHCH(CH3)- "
	C3H6O	58.0418 	"CH3-CO-CH2-: CH2 55%, C=O 25%, CH 10%; -CH2-CO-CH2-; HO-cyc (cycloalkanols); CH3OCH2CH2-, HO(CH2)3-, -CH2CH2-CO-, C3H7O-"
	C2H2O2	58.0054 	"CH3O-CO-, -CH2-CO-O-"
	C2H4NO	58.0292 	"CH3NH-CO-, -N(CH3)-CO-"
	CH2N2O	58.0165 	"-O-arN2, HO-arN2, -NH-CO-N(-)-"
	C2H2S	57.9880 	  
	C2H6N2	58.0529 	
	CNO2	57.9928 	
	CNS	57.9754 	
59	C2H3O2	59.0133 	"CH3O-CO-: CH2 50%, CH 20%, ar 9%; -CO-OCH2-: CH2 41%, CH 24%, ar 13%; CH3 40%, CH2 35%, CH 15%; -CH(OH)CH2O-: CH3 70%; CH2 50%, ar 25%" 
	C3H7O	59.0496 	"-C(CH3)20-; C2H5OCH2-: CH2 30%, C=O 25%, CH 25%; C2H5CH(OH)-: CH2 60%, CH15%; (CH3)2C(OH)-: CH2 55%, CH 20%; -CH2CH2OCH2-, -CH2CH2CH2O-, -CH(CH3)OCH2-"
	C2H5NO	59.0370 	"H2N-CO-CH2: CH2 80%, CH 15%; CH3-CO-NH-: CH 40%, CH2 30%; HO-N=CHCH2-; cyc-C(=N-OH)-CH2-; cyc-CH(NH2)-CH(OH)-; c-N(CH3)-CO-, CH3O-N=CH-, -CH2NH-CO-"
	C2H3S	58.9959 	"cyc-S-CH(CH3)-: C; -O-, S; -CH(CH3)S-; -CH=CH-S-; -CH2CH2S-, -CH2SCH2-, CH3SCH(-)-"
	C3H9N	59.0734 	"(C3H8N usually larger); H2NCH2CH2CH2-: CH2 80% ; (CH3)2NCH2-, C(CH3)2NH-, -CH2N(C2H5)-, (CH3)2CHNH-"
	CHNO2	59.0006 	"O2NCH2-, -O-CO-N(-)-, -O-CO-NH-"
	C3H4F	59.0297 	"cyc-CHFCH2CH2-, cyc-CH2CHFCH2-"
60	C2H4O2	60.0211 	"HO-CO-CH2-: CH2 60%, CH 12%; -O-CO-CH2-: CH2: CH2 25%; cyc-CH(OH)CH(OH)-"
	C3H8O	60.0575 	"cyc-CH(CH3)CH2O-, cyc-CH2CH(OH)CH2-"
	C2H6NO	60.0448 	"CH3-CO-NH-: CH2 40%, CH 40%; HOCH2CH(NH2)-: CH2 40%, C=0 40%; -CH(CH2OH)NH-: C=O; C=O; (CH3)2N-O-"
	C2H4S	60.0037 	-CH2CH2S-: CH2; CH2
	CHOP	59.9765 	arP
61	C2H5O2	61.0289 	"CH3-CO-O-: CH2 65%, CH 30%; HO-CO-CH2-, CH3O-CO-: CH2, CH; cyc-CH(OH)CH(OH)-; CH3OCH(-)O-, -OC(-)(CH3)O-"
	C5H	61.0078 	  
	C2H5S	61.0115		"CH3SCH2-: CH2 80%; -CH3SCH2-; CH3CH(SH)-, -CH(CH3)S-, -CH2CH2S-, C2H5S-"
	C2H2Cl	60.9844 	"-CH2CHCl-, ClCH=CH-, Cl-cyc"
	C2H6P	61.0207 	(CH3)2P- (abnd 100%)
	CH2OP	60.9843 	-P-CO-
	CH5N2O	61.0400 	H2N-CO-NH-
	C2H2OF	61.0089 	FCH2-CO-
	C3H6F	61.0453 	(CH3)2CF-
62	C5H2	62.0156 	
	C4N	62.0030 	"arN, ar-N(-)-"
	C2H3Cl	61.9923 	
	C2H7P	62.0285 	(CH3)2P-: -CO-; C2H5PH-
	C2H6S	62.0193 	C2H5S-
	CH4NO2	62.0241 	H2N-CO-O-
	C2F2	61.9968 	
	C2H6O2	62.0367 	
	CH2OS	61.9829 	
	CH4NS	62.0067 	
	H2N2S	61.9940 	
	CHNCl	61.9796 	Cl-arN
63	C5H3	63.0235 	
	C4HN	63.0108 	arN 
	C2H4Cl	63.0001 	"ClCH2CH2-: O 35%, C=O 15%, CH2 15%; ClCH(CH3)-: C=O 30%, CH2 20%, CH 20%"
	COCl	62.9637 	"Cl-CO-: O 40%, CH2 15%"
	CH3OS	62.9908 	"-CH2S(=O)-, CH3OS-,  CH3S(=O)-"
	C2HF2	63.0046 	"CHF=CF-, -CF(-)CF(-)-"
	CFS	62.9708 	cyc-CF(-)S-
	CH3O3	63.0082 	"-C(-O-)3, O=C(-O-)2"
64	C5H4	64.0313 	ar
	C4H2N	64.0186 	"arN, ar-N(-)-"
	C3N2 	64.0060 	arN2
	C4O	63.9949 	"ar(C=O), ar-CO-, arO "
	C2H2F2	64.0124 	-CH2CF2-
	S2	63.9448 	disulfides
	CH4OS	63.9986 	CH3O-S-
	SO2	63.9622 	
	C2H5Cl	64.0079 	
	HO2P	63.9714 	
	CHFS	63.9786 	
	CNF2	63.9998 	
65	C5H5	65.0391 	"unsatd hc, ar "
	C4H3N	65.0265 	"arN, ar-NH2, ar-NH-"
	C4HO	65.0027 	"ar-CO-, ar(C=O), arO, ar-O-, ar-OH"
	C3HN2	65.0138 	"arN2, ar-N=N-, arN-N(-)-, ar-CH=N-NH-"
	H2O2P	64.9792 	"O=P(OH)(-R)2, O=P(O-)3"
	C2H3F2	65.0203 	"CH3CF2-, -CHF-CF(-)-, ar-F2"
	HO2S	64.9700 	
	H2ClSi	64.9513 	
	CHNF2	65.0076 	
66	C5H6	66.0469 	"ar, CH3-pyridines "
	C4H2O	66.0105 	"ar-CO-, ar-O-, ar-OH"
	C4H4N	66.0343 	"arN (pyrrolyl-, N-R-pyrrolyl)"			
	C3H2N2	66.0216 	"arN2 (pyrazolyl),  ar-CH=N-NH-"			
	C3NO	65.9979 	"ar(NH-CO-), arN-OH, arON "			
	H2S2	65.9604 	-S-S-			
	C2N3	66.0090 	arN3			
	CFCl	65.9672 	"-CClF-, ClFC= "			
67	C5H7	67.0547 	polyunsatd/cyc hC			
	C4H3O	67.0184 	"substd ketones, furyl, ar(C-O)"			
	C4H5N	67.0421 	"pyrrolyl, cyc imines, substd amines"			
	C3H3N2	67.0295 	"arN2 (imidazoyl, etc), cyc hydrazone"			
	C3HNO	67.0057 	"ar(-NH-CO-), arN-OH, arN-CO-"			
	C2N3	67.0168 	arN3			
	CHFCl	66.9750 	FClCH-			
	CHOF2	66.9995	-CF2O-			
	ClS	66.9410 				
	OFS	66.9657 				
68	C5H8	68.0626 	"cyclopentyl, cyc/unsatd hc "
	C4H4O	68.0262	subst/cyc@-CO-/-O-
	C4H6N	68.0499	"subst/cyc@amines/imines,@nitriles"
	C3H2NO	68.0135 	"arN-OH, ar(NO) (isoxazolyl), ar-O-, ar(N-CO),@NC-CH2-CO-"
	C3H4N2	68.0373 	"arN2 (pyrimidinyl, etc), arN-NH2"
	C3O2	67.9898 	"ar-CO-O-, ar(C=O)-O-, substd/unsatd -CO-O-"
	C2N2O	68.0009 	NarNH-CO-
	C2H2N3	68.0246 	"arN3, arN2-NH-"
	C4HF	68.0062 	
	CN4	68.0120 	arN4
69	C5H9	69.0704 	"CH2=CHC(CH3)2-, cyclopentyl, other unsatd/cyc hc"
	C4H5O	69.0340	"cyc-CH(CH3)CH2-CO-, cyc-CH2CH(CH3)-CO-, cyc-CH2CH2CH(-CO-)-, cyc-(CH2)3-CO-; CH3CH=CH-CO-,@other C3H5-CO-, CH3-CO-CH=CH-; CH3C#CCH(OH)-, cyc/unsatd/subst -O-/OH "
	C3HO2	68.9976 	"unsatd/cyc/ar; /-O-/-OH (-CH=CH-CO-, etc) "
	CF3	68.9952 	"CF3-, polyfluoro/haloalkanes"
	C3H3NO	69.0214 	"-CH=CH-CO-NH-, HO-arN, OarN, ar-NO"
	C4H7N	69.0577 	"NC(CH2)3-, arN, substd/cyc amines"
	C3H5N2	69.0451 	unsatd/ar amines/imines/azo
	C2HN2O	69.0087 	
	C2H3N3	69.0325 	arN3
	C3HS	68.9802 	arS
	CHN4	69.0198 	arN4
70	C5H10 	70.0782 	"H-C5H10-Y*, H-C5H10-R-Y*, H-R-CH(CH3)C(CH3)=CH2, hc "
	C4H6O	70.0418 	cyc/substd ketones/-O-/-OH
	C4H8N	70.0656 	"cyc/subst amines (pyrrolidinyl, CH3N=CHCH2CH2-, aziridinyl-CH2-, cyc-CH2CH(CH3)CH(NH2)-"
	C3H2O2	70.0054 	"-CH2O-CO-CH2-, -CH2CH(-)-CO-O-, 4-pyrones, -CH2CH2O-CO-, -CO-CH2-CO-, HO-ar(C=O)"
	C3H4NO	70.0292 	"-CH2CH2-CO-NH-, cyc-N(C2H5)-CO-, CH3C(CN)(OH)-, H2N-CO-CH=CH-, NCO-CH(CH3)-, OCN-C2H4-, -CH(CH3)-CO-NH-"
	C3H6N2	70.0529 	"C3H7-N=N-, arN2, cycN2"
	C2H2N2O	70.0165 	HO-arN2
	C2NO2	69.9928 	-CO-NH-CO-
	C2H4N3	70.0403 	
71	C4H7O	71.0496 	"-(CH2)3-CO-: CH2 70%; -O- 25%, CH2 20%; C3H7-CO-: CH2 35%; -O- 25%; -(CH2)4O-, tetrahydrofuryl-, 1, 2-epoxybutyl-, -(CH2)3CH(OH)-, -(CH2)3OCH2-, -CH2CH2CH(CH2OH)-, -CH2CH2OCH2CH2-"
	C5H11	71.0860 	
	C3H3O2	71.0133 	"-CH2CH2-CO-O-, -CH2-CO-OCH2-; -CH2CH2O-CO-, -CH(CH3)-CO-O-, -CO-CH2-CO-, cyc-CH2CH(O-)CH(O-)- "
	C4H9N	71.0734 	"-(CH2)4N(-)-, (CH3)2NCH2CH2-, arN-C3H7, H2N(CH2)4-, cycN"
	C3H5NO	71.0370 	
	C3H3S	70.9959 	
	C3H7N2	71.0607 	
	C2H3N2O	71.0244 	
	C2HNO2	71.0006 	
	C2N2F	71.0044 	
72	C4H8O	72.0575 	"C2H5-CO-CH2-, CH3-CO-CH(CH3)-: CH2 75%; HO-cyc, CH3O-cyc, C2H5OCH2CH2-, CH3OCH2CH2CH2-"
	C3H4O2	72.0211 	"C2H5O-CO-, CH3O-CO-CH2-"
	C3H6NO	72.0448 	"(CH3)2N-CO-: -NH-, ar, -N(-)-; CH3-CO-NHCH2-: CH2 70%; C2H5NH-CO-: -NH-, C; H2N-CO-CH2CH2-: CH2, CH; HON=CHCH2CH2-"
	C4H10N	72.0812 	"C3H7NHCH2-, C3H7CH(NH2)-, (CH3)2NCH(CH3)-; -CH(C3H7)NH-, -CH2N(C3H7)-, (C2H5)2N-, C3H7NHCH(-)-, C4H9NH-, C4H9N(-)-"
	C2H2NO2	72.0084 	"-CH(-CO-OH)NH-, -N(CH3)-CO-O-, -CH(NH2)-CO-O-, -CH2O-CO-NH "
	C2H4N2O	72.0322 	-N(CH3)-CO-N(-)-
	C3H8N2	72.0686 	
	C2H2NS	71.9910 	SCNCH2-
	C3H5P	72.0129 	
73	C3H5O2	73.0289 	"-CH2CH2-CO-O-: CH2 60%; Si 50%; HO-CO-CH2CH2-: CH2 55%, CH 16%, S 12%; C2H5O-CO-: CH2 55%, CH 18%; CH3O-CO-CH2- (also m/z 74): CH2 37%, CH 34%; CH3-CO-OCH2-: CH2 50%, CH 30%; -CH2OCH2CH2O-, cyc-CH2CH2OCH(-)-O-, -CH2CH(OH)CH(OH)-"
	C4H9O	73.0653 	"-(CH2)4O-: CH2 75%; Si 50%; C2H5CH(OCH3)-: CH2 80%; CH3(CH2)3O-: C=O 80%; C2H5-CO- (also m/z 72): CH2 80%; C2H5CH2CH(OH)-, (CH3)2CH(OH)-, -(CH2)3OCH2-, (CH3)2CHOCH2-, C2H5CH2OCH2-, C2H5C(CH3)(OH)-,  cyc-C(CH3)(C2H5)O-"
	C3H7NO	73.0526 	"CH3-CO-NH-CH2- (also m/z 72): CH2 85%; -CH2CH=NOCH3, CH3C(=NOCH3)-; -CH2CH(=NOCH3)-: CH2; C=O; -CH2CH2C(=N-OH)-: CH2 50%; CH2 50%; CH3-CO-N(CH3)-; C2H5-CO-NH-; (CH3)2C=N-O-, -CH(OCH3)-CH(-NH-)-, -CH2-CO-NH-CH2-, CH3NHCH2CH(-)-O-"
	C2H3NO2	73.0163 	"-NHCH2-CO-O-: C=O; Si; -NHCH(-)-CO-O-, -N(-)-CH2-CO-O-; HO-CO-CH(NH2)-: CH2; -CH=C(NO2)-"
	C2HO3	72.9925 	"-OCH2-CO-O-: CH2, ar, Si; Si, CH2; -OCH(-)-CO-O-, -OC(-)2-CO-O-, HOCH(-)-CO-O-; -CO-CO-O-: ar, -O-; Si, CH2 "
	C3H9Si	73.0373 	"(CH3)3Si-, -CH2Si(CH3)2-"
	C2H5N2O	73.0400 	O=N-N(C2H5)-: CH2 
	C3H9N2	73.0764 	(CH3)2N-N(CH3)-
74	C3H6O2	74.0367 	"CH3O-CO-CH2-: CH2 70%, CH 13%; CH3O-CO-CH=: =CH-; HO-CO-CH(CH3)-: CH2 70%, -NH- 20%; cyc-CH(OH)CH(OCH3)-"
	C6H2	74.0156 	
	C2H4NO2	74.0241 	"HO-CO-CH(NH2)-: CH2 75%, CH 20%; -CH2O-CO-N(-)-"
	C4H10O	74.0731 	"CH3O-cyc, cycO, HO-cyc"
	C2H2O3	74.0003 	"cyc-OCH(O-)CH(OH)-,  -OC(OCH3)O-, -OC(-OCH2-)O-"
	C3H6S	74.0193 	"cyc-SC(CH3)2-, -(CH2)3S-, -CH2CH2SCH2-"
	C3H8NO	74.0605 	"-CH(OH)CH(NHCH3)-,  -CH(OH)CH(CH3)NH-, CH3CH(OH)CH(NH2)-"
	C5N	74.0030 	arN
	C3F2	73.9968 	F2-ar
	CH2N2O2	74.0114 	ONNH-CO-
	C2H4NS	74.0067 	arNS
	CH2N2S	73.9940 	"H2N-arNS, -S-arN2"
	C3H3Cl	73.9923 	Cl-ar
75	C6H3	75.0235 	
	C3H7O2	75.0445 	"CH3O-CO-CH2-: CH2 65%, CH 15%; (CH3O)2CH-: CH2 70%, CH 20%; C2H5-CO-O: CH2 70%, CH 20%; HOC2H4OCH2-, HOC2H4CH(OH)-, CH3OCH2CH(OH); CH3-CO-OCH2-; C2H5OCH(-)O-"
	C5HN	75.0108 	arN 
	C2H7OSi	75.0165 	"-Si(CH3)2-O-, (CH3)2Si(OH)- "
	C3H4Cl	75.0001 	
	C3H7S	75.0271 	"C2H5SCH2-, CH3SCH(CH3)-; C3H7S-"
	C2H5NO2	75.0319 	"HO-CO-CH(NH2)-, -NHCH2-CO-O-, NH2-CO-OCH2-"
	C2H3O3	75.0082 	"cyc-CH(-O-)-CO-O-, -OCH-CO-O- "
	C2H3OS	74.9908 	
	C3HF2	75.0046 	ar-F2
	C3H9NO	75.0683 	CH3CH(OH)CH(NH2)-
	C2OCl	74.9637 	
	C2H7N2O	75.0556 	CH3-CO-NH-NH-
	C4H8F	75.0610 	
76	C6H4	76.0313 	
	C5H2N	76.0186 	arN 
	C5O	75.9949 	"ar(CO), arO"
	C4N2	76.0060 	arN2
	C3H5Cl	76.0079 	ClC3H6-
	C3H8S	76.0350 	C3H7S-
	CS2	75.9448 	"arS2, -S-C(=S)-, pyrolysis product"
	C2H4O3	76.0160 	"CH3O-CO-O-, HO-CO-CH(OH)-, -CH(OH)-CO-O "
	C3H2F2	76.0124 	
	H2N3O2	76.0144 	
77	C6H5	77.0391 	"phenyl-Y, Y-phenyl-Y'"
	C5H3N	77.0265 	"arN, ar-N(-)-"
	C5HO	77.0027 	ar-CO-
	C4HN2	77.0138 	"arN2, arN-N(-)-"
	C3H3F2	77.0203 	"-C2H4CF2-, CF2=CHCH2-"
	C3H6Cl	77.0157 	C2H5CHCl-
	CH2O2P	76.9792 	CH3OP(=O)(-)-
78	C6H6	78.0469 	phenyl
	C5H4N	78.0343 	"pyridyl-, other arN, ar-NH-"
	C5H2O	78.0105 	"ar-CO-, arO"
	C4H2N2	78.0216 	"arN2, ar-N=N-"
	C4NO	77.9979 	"arN-CO-, ar-NO, arNO"
	CH2S2	77.9604 	"-CH2-S-S-, -SCH2S-, SCH(-)S-"
	C3N3	78.0090 	
	C2OF2	77.9917 	-CF2-CO-
79	C6H7	79.0547 	
	C5H3O	79.0184 	"ar-O-, ar-CH2OH, subst cyc(C=O)"
	C5H5N	79.0421 	"arN, subst cyc-NH-"
	C4H3N2	79.0295 	arN2
	C4HNO	79.0057 	"arN-CO-, arNO, ar-NO"
	CH4O2P	78.9949 	"CH3OP(=O)(-)2, CH3P(=O)(-)O-"
	CH3O2S	78.9857 	"CH3OS(=O)-, -CH2OS(=O)-"
	Br	78.9183 	
	CH3S2	78.9683 	CH3-S-S-
	C2H4OCl	78.9950 	"ClCH2OCH2-, ClCH2CH(OH)-"
	C2HFCl	78.9750 	
	O3P	78.9585 	"-OPH(=O)O-, -OP(-)(=O)O-"
80	C6H8	80.0626 	cyclohexenes
	C5H4O	80.0262 	arO
	C5H6N	80.0499 	"arN (pyridyl, pyrrolyl-CH2-), ar-NH2, subst cycloalkanones"
	C4H2NO	80.0135 	"arN-OH, ar(N-CO-), ar-NO"
	C4H4N2	80.0373 	"arN2, arN-NH2"
	C3H2N3	80.0246 	"arN3, arN2-NH-"
	C4O2	79.9898 	"ar-COOH, -CO-C#C-CO-, ar-CO-O-"
	HBr	79.9261 	
	C3N2O	80.0009 	"arN2-O-, arN2(C=O)"
	CH4O2S	79.9935 	CH3OS(=O)-
	HO3P	79.9663 	-OPH(=O)O-
	CH4S2	79.9761 	CH3S-S-
81	C6H9	81.0704 	"polyisoprenes, polyunsatd/cyc hc"
	C5H5O	81.0340 	"furyl-CH2-: -O- 49%, -S- 28%, CH2 11%; unsatd/subst hc-CO- ; ar-OH, subst/unsatd/cyc hc-OH "
	C5H7N	81.0577 	"arN (CH3-pyrrolyl etc), unsatd/cyc/substd imine/amine, ar amine "
	C4H3NO	81.0214 	"Nar(C=O), NarO, unsatd methoxime, unsatd oxyamine"
	C4HO2	80.9976 	"subst/cyc-O-CO-, arO2, -O-ar-O-"
	C4H5N2	81.0451 	arN2
	C3HN2O	81.0087 	
	C3H3N3	81.0325 	arN3
	C2F3	80.9952 	
	H2O3P	80.9741 	-OP(=O)O-
	C4HS	80.9802 	arS
	C5H2F	81.0140 	ar-F; C2H3OF2(CH3OCF2-)
	C2H3FCl	80.9907 	"-CH2CFCl-, -CH2CHFCl"
82	C6H10	82.0782 	"cyclohexyl, subst/unsatd hc"
	C5H6O	82.0148 	"furyl-CH2-, ketones, cyc-OH, cycO"
	C5H8N	82.0656 	"pyrrolizidinyl, cyc/substd/unsatd amines/imines, NC-C4H8-"
	C4H4NO	82.0292 	"unsatd ketoamines; CH3NHC(-)=CH-CO-, arNO; CH3-isoxazolyl, arN(C=O), subst/cyc aminoethers"
	C4H2O2	82.0054 	"ar(C=O)2, HO-CO-C#CCH2-, ar-CO-OH, unsatd-CO-O-"
	C4H6N2	82.0529 	"arN2 (pyrimidinyl-CH2-), unsatd amines"
	C3H2N2O	82.0165 	
	C3H4N3	82.0403 	triazinyl
	C3NO2	81.9928 	
	C4H2S	81.9880 	
	CCl2	81.9376 	
	C2H2N4	82.0276 	arN4
	C2HF3	82.0030 	
	CF2S	81.9692 	
83	C6H11	83.0860 	"cyclohexyl, CH3CH=CHC(CH3)2-"
	C5H7O 	83.0496 	"cyc ketones; -CH2C(CH3)2-CO-, lactones, cyc/subst/unsatd -O-/-OH/-CO-; (CH3)2C=CH-CO-"
	C4H3O2	83.0133 	"diketones, ketoesters, ar-CO-OCH3, subst/cyc -O-/-OH/-CO-; HO-furyl-"
	C5H9N	83.0734 	"NC(CH2)4-, cyc/substd amines (piperidyl)"
	C4H5NO	83.0370 	"unsatd/cyc; -NH-/-NH2/C=O/-OH/-O-/-CH=N-OH; cyc-NH-CO-CH=C(CH3)-, -CH=C(CH3)NH-CO-, H2N-CO-C(CH3)=CH-"
	CHCl2	82.9454 	"CHCl2, -CCl2- "
	C4H7N2	83.0607 	-CH=CHC(CH3)=NNH-
	C3H3N2O	83.0244 	"arN2(C=O), arN2-OH"
	C3HNO2	83.0006 	
	C3H5N3	83.0481 	
	C5H4F	83.0297 	
	C4H3S	82.9959 	thiophenyl-
	C2H2F3	83.0108 	
	FO2S	82.9603 	F-S(=O)O-
84	C5H8O	84.0575 	"cyc/subst ketones; 2-R-cyclopentanones, cyc/substd/unsatd; -O-/-OH"
	C6H12	84.0938 	"H-C6H12-Y*, H-C6H12-R-Y*"
	C4H4O2	84.0211 	"beta diketones, CH3-4-pyrones, substd/cyc -O-CO-, HO-CO-"
	C5H10N	84.0812 	"cyc/subst amines; 2-piperidynl, N-CH3-pyrrolidinyl, cyc-CH2CH2CH(NHC2H5)-"
	C4H6NO	84.0448 	"subst/cyc amides; -CH2CH(=NH)-CO-CH3, -CH2CH2CH2-CO-NH-, -CH2CH2CH(NH2)-CO-, -CH(NH2)CH2CH2-CO-, OCN-C3H6"
	C4H8N2	84.0686 	"C4H9-N=N-, -(CH2)3C(-)=N-NH-, -N(-)(CH2)3N(-)-, arN2"
	C3H4N2O	84.0322 	"HO-arN, -CH(-)NH-CO-NHCH(-)-, H2N-CO-arN, N2ar(C=O)"
	C3H2NO2	84.0084 	"-N(-CO-CH3)-CO-, -C(NH2)=CH-CO-O-, HO-CO-arN, ar-NO2"
	C3O3	83.9847 	-O-CO-CH2-CO-
85	C5H9O	85.0653 	"-(CH2)4-CO-: CH2 70%; -O- 27%; C4H9-CO-: CH2 35%; -CH(-)2 30%; cycO (tetrahydropyryl-), -(CH2)5O-, -(CH2)4CH(-)O-, -(CH2)3OCH2CH2-, C3H7C(-)(CH2OH)-, -(CH2)4OCH2-"
	C6H13	85.1017 	
	C4H5O2	85.0289 	"CH3-CO-CH2-CO-; gamma-lactones; -(CH2)3-CO-O-, -CH2CH2-CO-OCH2-, -CH2CH2O-CO-CH2-, 2-(methylethylene ketal)-, -CH2CH(O-)CH2CH(O-)-, -O(CH2)3-CO-"
	C5H11N	85.0890 	"(CH3)2N(CH2)3-, -(CH2)5N(-)-, arN-C4H9, C4H9CH=N-"
	C4H7NO	85.0526 	
	C3H3NO2	85.0163 	
	C3HO3	84.9925 	
	CClF2	84.9656 	
	C4H9N2	85.0764 	"cycN2, (CH3)2N-N=CH-CH2-"
	C4H5S	85.0115 	cycS
86	C5H12N	86.0968 	"(C2H5)2NCH2-, C4H9NHCH2-, C3H7N(CH3)CH2-, C4H9CH(NH2)-, (CH3)2NC(CH3)2-; -CH2N(C4H9)-, -CH(CH3)N(CH3)CH(CH3)-, -CH2CH2N(C2H5)CH2-"
	C4H6O2	86.0367 	1-dioxolanyl(-)-cyc-CH2-
	C5H10O	86.0731 	"C3H7-CO-CH2-, C2H5-CO-CH(CH3)-, Y*-C5H10O-"
	C4H8NO 	86.0605 	"H2N-CO-CH2CH(CH3)-, CH3NH-cyc-OH"
	C3H4NO2	86.0241 	"-CH(-CO-OCH3)-NH-, -CH(NH2)-CO-OCH2-"
	C3H6N2O	86.0478 	-NH-CO-NH-
	C3H2O3	86.0003 	
	C4H10N2	86.0842 	(CH3)2NN=CH-CH2-
	C2H4N3O	86.0351 	H2N-CO-NH-N=CH-
87	C4H7O2	87.0445 	"CH3O-CO-CH2CH2-: CH2 55%, -CH= 15%; CH3O-CO-CH(-)-CH2-: CH2 70%; CH2 55%; CH3O-CO-CH=CH-: CH2; -O-CO(CH2)3-, HO-CO-(CH2)3-, -CO-O(CH2)3-, -CH2O-CO-(CH2)2-, -CO-(CH2)3-O-, CH3-dioxolanyl-, CH3CO-O(CH2)2-"
	C5H11O	87.0809 	"HOC(C2H5)2-, HOC(C3H7)(CH3)-, HOCH(C4H9)-; C4H9OCH2-, C2H5OC(CH3)2-, CH3OCH(C3H7)-; -(CH2)5-O-, -(CH2)4OCH2-, -(CH2)3O(CH2)2-, -CH(OH)(CH2)4-, -CH2C(OH)(-)C3H6-"
	C4H9NO	87.0683 	"CH3ON=C(CH3)CH2-: CH2; (CH3)2N-CO-CH2-; CH3CO-NH(CH2)2-, C3H7CO-NH-, CH3CO-N(CH3)-CH2-"
	C3H3O3	87.0082 	"-CO-CH2CO-O-, -CO-CH(-)-CO-O-, -CO-O-CH2CH2O.-, -CH(O-)-CH(OH)-CH(O-)-, -CH(OH)CH2O-CO-, -CH(C2H5)O-CO-, -(CH)3(-)(OH)(O-)-O-"
	C4H7S	87.0271 	"Thiacyclopentyl-: CH2; other thiacycloalkanes (cycS)"
	C3H5NO2	87.0319 	"-CH2C(NH2)(COOH)-; CH3O-CO-CH(NH2)-; CH3CO-N(-)-CO-, -CH(OH)CH2N(-)-CO-, -NHCH(-)-CO-OCH2-, CH3O-CO-CH2-NH-, (arN)-CO-OCH2-, -C(=NOH)-C(OH)(-)-"
	C5H13N	87.1047 	(C2H5)2NCH2-
	C4H4Cl	87.0001 	
	C3H7N2O	87.0556 	
	C4H11Si	87.0530 	C2H5Si(CH3)2-
88	C4H8O2	88.0524 	"CH3O-CO-CH(CH3)-: CH2 70%; C2H5O-CO-CH2-: CH2 55%, C=O 15%, CH 15%; HO-CO-CH(C2H5)-, HO-CO-C(CH3)2-; cyc-CH(OCH3)CH(OCH3)-; C2H5OC(-)(CH3)O-"
	C7H4	88.0131 	ext/substd ar 
	C3H6NO2	88.0397 	"-CH(-CO-OCH3)-NH-: CH2 60%, C=O 70%; CH3O-CO-CH2NH-: C=O 65%, Si 15%; CH3O-CO-CH(NH2)-"
	C3H4O3	88.0160 	-CH(O-)CH(OCH3)O-
	C4H5Cl	88.0079 	
	C5H12O	88.0887 	CH3O-cyc
	C6H2N	88.0186 	arN
	C4H10NO	88.0661 	CH3OCH2NHCH(CH3)-
	C4H8S	88.0350 	(-CH(CH3)CH2SCH2-
	C3H8N2O 	88.0635 	
89	C7H5	89.0391 	"ext-arY, unsatd-ar"
	C6H3N	89.0265 	arN
	C4H9O2	89.0602 	"C3H7-CO-O-: CH2 85%; C3H7OCH(-)O-"
	C3H5O3	89.0238 	CH3-CO-CO-O-
	C6HO	89.0027 	"arO, ar-CO-"
	C4H9S	89.0428 	"C3H7SCH2-, C2H5SCH(CH3)-"
	C3H7NO2	89.0475 	"HO-CO-CH(NH2)CH2-, CH3O-CO-CH2NH-, HO-CO-C(CH3)(NH2)- "
	C3H9OSi	89.0322 	-CH2OSi(CH3)2-
	C3H5OS	89.0064 	"1, 3-oxathiolanyl"
	C4H6Cl	89.0157 	ClCH=C(CH3)CH2-
	C5HN2	89.0138 	arN2
90	C7H6	90.0469 	
	C6H4N	90.0343 	"arN, ar-NH-"
	C6H2O	90.0105 	"ar(CO), arO, ar-O-"
	C5H2N2	90.0216 	arN2
	C3H6O3	90.0316 	"CH3O-CO-CH(OH)-: CH, CH2; C2H5O-CO-O-"
	C3H8NO2	90.0554 	CH3O-CO-CH2NH-
	C4H7Cl	90.0235 	C4H8Cl-
	C4H10S 	90.0506 	C4H9S-
	C5NO	89.9979	
	C4H10O2	90.0680 	
	C3H6OS	90.0142 	
	C4N3	90.0090 	"arN2-N(-)-, arN3"
91	C7H7	91.0547 	"phenyl-CH2-Y, phenyl-C(-Y)n, CH3-phenyl-Yn"
	C6H5N	91.0421 	"cycN-ar, ar-NH-, arN"
	C6H3O	91.0184 	"ar-CO-, arO"
	C5H3N2	91.0295 	"arN2, ar-N=N-"
	C4H8Cl	91.0314 	"Cl(CH2)4-: n-CnH2n+1; C2H5CCl(CH3)-"
	C5HNO	91.0057 	"ar-NO, cycN(C=O), arN(C=O)"
	"C3H4OCl,"	90.9950 	ClC2H4-CO-
	C2H5NOS	91.0094 	
	CHNS2	90.9556 	-C(=S)NH-
	C3H7O3	91.0394 	C2H5OC(-)(-O-)2
92	C7H8	92.0626 	phenyl-CH2-
	C6H4O	92.0262 	"arO, ar(C=O), ar-O-, ar-OH"
	C6H6N	92.0499 	"pyridyl-CH2-, ar-NH2, ar-NH-"
	C5H4N2	92.0373 	arN2
	C5H2NO	92.0135 	"ar-NO, arN-CO-"
	C4H2N3	92.0246	
	C4N2O	92.0009 	
	C5O2	91.9898 	
	CHBr	91.9261 	
	C3H8O3	92.0473 	(HOCH2CH(OH)CH(OH)-)-
93	C7H9	93.0704 	"terpenes, cyclohexenyl-, polyunsatd cyc hc"
	C6H5O	93.0340 	"phenyl-O-, HO-phenyl-ar-CO-, ar-O-, subst/cyc(C=O)"
	C6H7N	93.0577 	"pyridyl-CH2-, phenyl-NH-, ar-amines, cyc-NH-, CH3-pyridyl-"
	C5H5N2	93.0451 	"CH3-pyrazinyl-, R2N-pyridyl-, arN2, ar-N=N-, arN-NH2"
	C5H3NO	93.0214 	"imidazoyl, arN-CO-, cyclopentadienyl-NO, ar-NO, arN-OH"
	C5HO2	92.9976 	"ar-(O-)2, arO-CO-"
	C4H3N3	93.0325 	arN3
	C4HN2O	93.0078 	"arN2(C=O), ar-NH-CO-NH-"
	C3F3  	92.9952 	"unsatd, perhalocarbon"
	C3H6OCl	93.0106 	"ClC2H4OCH2-, ClCH2C(OH)(CH3)-"
	CH2Br	92.9339 	"BrCH2-, cyc-Br"
	CH2O3P	92.9741 	CH3OP(=O)(-)O-
	C2H6ClSi	93.9922 	(CH3)2SiCl-
94	C7H10	94.0782 	polyunsatd/cyc hc
	C6H6O	94.0418 	"C6H5O-: CH2 55%, C=O 15%; ar-OH, ar-OCH3, substd alkanones, cyc-CO-O-"
	C6H8N	94.0656 	"subst amines, imines"
	C5H4NO	94.0292 	"pyrrolyl-CO-, HO-arN-"
	C5H2O2	94.0054 	"ar(C=O)-CO-, subst esters"
	C5H6N2	94.0529 	"arN2 (CH3-pyrazinyl-); subst/unsatd cycN2 "
	C4H2N2O 	94.0165 	C3H2N2-CO-
	C4H4N3	94.0403 	ext-arN3
	C3H2N4	94.0276 	ext-arN4
	C2Cl2	93.9376 	
	C2H6S2	93.9917 	C2H5S-S-
95	C7H11	95.0860 	polyunsatd/cyc hc
	C6H7O	95.0496 	"ar or cyc/subst/unsatd; oxygen cpds"
	C5H3O2	95.0133 	"furyl-CO-, ar(-O-CO-), subst/cyc -CO-OCH3"
	C6H9N	95.0734 	"cyc imine, nitriles, cyc/unsatd amine"
	C5H5NO	95.0370 	"pyridyl-O-, ar(N-CO-), subst/cyc-NH-CO-, ar-NO"
	C5H7N2	95.0607 	"arN2, cyc imine"
	C4H3N2O	95.0244 	"imidazole-CO-, arN2-CO-, arN2-OH"
	C4HNO2	95.0006 	"arN(CO)2, -CO-ar-NH-CO- "
	C4H5N3	95.0481 	arN2-NH2
	C3HN3O	95.0117 	
	C2HCl2	94.9454 	
	C3H3N4	95.0355 	
	CH4O3P	94.9898 	CH3OP(=O)O-
	C6H4F	95.0297 	ar-F
96	C7H12	96.0938 	substd/cyc/unsatd hc
	C6H8O	96.0575 	"R-CO-, substd/cyc ketones, cyc-O-"
	C6H10N	96.0812 	"quinolizidinyl, substd/cyc amines, NC-C5H10-"
	C5H4O2	96.0211 	unsatd esters
	C5H6NO	96.0448 	
	C5H8N2	96.0686 	arN-NH-
	C4H2NO2	96.0084 	NHar(C=O)2
	C4H4N2O	96.0322 	arN2-OH
	C4H6N3	96.0559 	C2H5-arN3
	C2H2Cl2	95.9532 	
	C3H4N4	96.0433 	
97	C7H13	97.1017 	CH3-cyclohexyl 
	C6H9O	97.0653 	" cyc ketones (cyclopentyl-CO-, cyc-CH2CH(C3H7)-CO- etc), epoxycyclohexyl, C3H7CH=CH-CO-, cyc/subst/unsatd -O-/-OH"
	C5H5O2	97.0289 	"cyc/unsatd/subst; C=O/(C=O)2/-O-/(-O-)2/-OC(-)2O-(cyclopentadione)"
	C6H11N	97.0890 	"NC(CH2)5-, CH3-pyrrolizidinyl-, subst/cyc/unsatd amines"
	C5H7NO	97.0526 	"CH3-oxazoles, cyc/unsatd -N(-)-/-NH-/-N=/C=O/-OH/-O-"
	C4H3NO2	97.0163 	"-CH=CH-CO-N(-)-CO-, ar-NO2"
	C4H5N2O	97.0400 	carbamyl
	C4HO3	96.9925 	
	C5H9N2	97.0764 	
	C5H5S	97.0115 	"thiophenyl-CH2-, ar-SCH3"
	C2H3Cl2	96.9611 	
	C2OF3	96.9901 	"-C2HF3-O-, CF3-CO-"
	C7H14	98.1094 	"H-C7H14-Y*, H-C7H14-R-Y* "
	C6H10O	98.0731 	"2-R-cyclohexanone, R-(CH2)5-CO-Y, C2H5CH=CH-CO-CH2-, cyc/subst ketones/-O-/-OH"
	C5H6O2	98.0367 	"furyl-CH(OH)-, 2, 3-(CH3)2-4-pyrones, substd/cyc esters"
	C6H12N	98.0968 	"cyc/substd amines, piperidine-CH2-, C4H9-CH=NCH2-"
	C5H8NO	98.0605 	"cyc amides (valerolactams etc), (CH3)2NCH=CH-CO-, -(CH2)3CH(NH2)-CO-, OCN-C4H8-"
	C4H4NO2	98.0241 	H2N-CO-CH=CH-CO-
	C5H10N2	98.0842 	C5H11-N=N-
	C4H2O3	98.0003 	"HO-CO-CH=CH-CO-, HO-CO-ar-CO-"
	C4H6N2O	98.0478 	
	C4H4NS	98.0065 	thiazole-CH2-
99	C6H11O	99.0809 	"C5H11-CO-: CH2 20%, -CH= 18%, -NH- 16%; -(CH2)5-CO-, -(CH2)5CH(OH)-, -(CH2)4CH(OH)CH(-)-, -CH2CH(C4H9)O-"
	C5H7O2	99.0445 	"delta- and CH3-gamma-lactones, -(CH2)4-CO-O-, CH3-CO-C2H4-CO-, 1-dioxolanyl(-)-cyc-CH2CH2-"
	C7H15	99.1173 	satd hc
	C5HONO	99.0319 	OCN-(CH2)4-
	C4H5NO2	99.0319 	arN-CO-OC2H5
	C6H13N	99.1047 	
	C4H3O3	99.0082 	
	C5H11N2	99.0920 	cycN2
	C5H7S	99.0271 	cycS
	C4H5NS	99.0145 	thiazole-CH2-
100	C5H10NO	100.0761 	"(C2H5)2N-CO-, -(CH2)4-NH-CO-, CH3O-N=C(CH3)CH(CH3)- "
	C5H8O2	100.0524 	"CH3O-CO-CH=CH-CH2-, (CH3-CO-)2CH- "
	C6H14N	100.1125 	"C5H11CH(NH2)-, cyc-CH2CH(CH3)C(CH3)2-N(-)-, -CH2CH(CH3)-N(C2H5)-CH2-"
	C6H12O	100.0887 	"C2H5-CO-C(CH3)2-, C4H9O-ar"
	C4H6NO2	100.0397 	"-CH2C(=NOCH3)-CO-, -CH=CHCH2NH-CO-O-"
	C4H4O3	100.0160 	"substd trioxane, HO-CO-C(-)2CH2-CO-"
	C8H4	100.0313 	ar/unsatd hc
	C5H12N2	100.0998 	"cyc-CH2CH2N(CH2CH2CH2NH-)-, -CH2CH2N(-)(CH2)3NH- "
	C4H8N2O	100.0635 	-NH(CH2)3N(-)-CO-
	C3H4N2O2	100.0033 	HO-CO-CH(-)NH-CO-
	C2F4	99.9936 	
101	C5H9O2	101.0602 	"C2H5O-CO-CH2CH2-, C4H9O-CO-, cyc-CH2CH2C(OCH3)2-, C2H5-dioxolanyl-, -(CH2)3-CO-O-CH2-"
	C8H5	101.0391 	"-styrenyl-Y2*, ext-ar"
	C6H13O 	101.0966 	"C5H11CH(OH)-, C4H9C(CH3)(OH)-, CH3CH(-)(CH2)3C(-)(OH)-, cyc-(CH2)3CH(-CH2CH2O-)-"
	C4H5O3	101.0238 	"CH3O-CO-CH2-CO-, -O(CH2)3-CO-O-, -CH2-CO-OCH2CH2O-, CH3O-CO-CH(-)-CO-, cyc-CH2CH(-O-)CH(-O-)-O-"
	C7H3N	101.0265 	"ext-arN, NC-phenyl-"
	C4H7NO2	101.0475 	"HO-CO-CH(NH2)CH2CH2-Y, CH3O-CO-CH=CH-N(-)-, C2H5O-CO-arN"
	C5H11NO	101.0839 	"CH3-CO-NH(CH2)3-, (CH3)2N(CH2)3O-"
	C5H9S	101.0428 	CH3-thiacyclopentyl-
	C4H5OS	101.0064 	-CH2CH2S-CO-CH2-
	CFCl2	100.9360 	
	C4H6OP	101.0156 	-phospholane-O-
	C4H7NS	101.0299 	SCN-(CH2)3-
	C3H7N3O	101.0586 	H2N-CO-NH-N=CH-CH2-
102	C7H12	96.0938 	"phenyl-C(-)=CH-, ext-ar, quinolines"
	C7H4N	102.0343 	"ext-arN, phenyl-arN"
	C5H10O2	102.0680 	"C2H5O-CO-CH(CH3)-, C3H7-CO-CH2-, -(CH2)4-CO-O-, C3H7O-CO-CH(-)- "
	C7H2O	102.0105 	"ext-ar(C=O), ext-arO"
	C4H8NO2	102.0554 	"C2H5O-CO-CH(NH2)-, C2H5O-CO-NHCH2-, (CH3-CO-)2N-, -C4H8-ONO, CH3O-CO-C(CH3)(NH2)-, CH3-CO-NHCH2CH(OH)-, -NH(CH2)3-CO-O-"
	C6H2N2	102.0216 	"ext-arN2, NC-pyridyl-"
	C4H6O3	102.0316 	"-CH(OH)CH(OH)CH(OH)CH(-)-, CH3O-CO-CH(-CH2OH)-, CH3-CO-CH(-)-CO-O-"
	C5H12NO	102.0917 	C2H5OCH2CH2CH(NH2)-
	C3H4NO3	102.0190 	cyc-CH(OH)-CH(-NH-CO-)-
103	C8H7	103.0547 	"phenyl-C2H2-, indoles, benzofurans, phenyl-CH(-)-CH(-)- "
	C7H5N	103.0421 	"phenyl-arN, phenyl-CH=N-, ext-arN, cyc-CH(phenyl)-N(-)-"
	C7H3O	103.0184 	"ext-ar(C=O), Y*-phenyl-CO-Y*, ar-CH=CH-CO-, ext-ar-O-"
	C5H11O2	103.0758 	"(C2H5O)2CH-, C4H9OCH(-)O-, C4H9-CO-O-, HOCH(CH3)CH2OCH(CH3)-, CH3OCH2CH2CH(OCH3)-, C4H9O-CO-"
	C4H7O3	103.0394 	"CH3O-CO-CH2CH(OH)-, CH3-CO-CH2-CO-O-, CH3O-CO-CH(OCH3)-, cyc-CH2-CH(CH2OH)-OCH(-)-O-"
	C4H11OSi	103.0479 	"(CH3)3SiOCH2-, -CH2OCH2-Si(CH3)2-"
	C6H3N2	103.0295 	"ext-arN2, cyc-NN(phenyl)-, -NH-phenyl-N(-)-"
	C5H11S	103.0584 	"C4H9SCH2-, C2H5SC(CH3)2-, -CH(C2H5)SCH(CH3)-"
	C5H8Cl 	103.0314 	cyc-CCl(-)-C(-)(CH3)-C(-)(CH3)-
	C3H3O4	103.0031 	cyc-CH(OH)-CH(-CO-OH)-O-
104	C8H8	104.0626 	"tetralins, indans, phenyl-CH2CH2-Y*, o-CH3-phenyl-CH2-Y*, phenyl-cycR"
	C7H6N	104.0499 	"phenyl-arN, ext-arN, cyc-CH(phenyl)-NH-, phenyl-C(-)=N-, cyc-CH2N(phenyl)-"
	C7H4O	104.0262 	"ext-ar(C=O), cyc-phenyl-CO-, Y-phenyl-CO-, cyc-C(-)(phenyl-O-)"
	C6H4N2	104.0373 	"phenyl-arN2, ext-arN2 "
	C6H2NO	104.0135 	ON-phenyl-
	C4H8O3	104.0473 	"HOC2H4O-CO-CH2-, C3H7O-CO-O-, CH3O-CO-CH(OCH3)-"
	C5H2N3	104.0246 	ext-arN3
	C5H12O2	104.0836 	
	C4H8OS	104.0299 	"-CH2OCH2CH2SCH2-, HOCH2CH2SCH2CH2-"
105	C7H5O 	105.0340 	"phenyl-CO-: -O- 25%, CH2 20%, -NH- 20%, CH 20%; cyc-CH(phenyl)-O-: -O- 75%, CH2 15%; CH2 35%, C=O 25%, CH 25%; ext-ar(C=0), -phenyl-CO-, -phenyl-OCH2-, phenyl-C(-)(OH)-"
	C8H9	105.0704 	"phenyl-CH(CH3)-, CH3-phenyl-CH2-, (CH3)2-phenyl"
	C7H7N	105.0577 	"phenyl-N(CH3)-, -phenyl-CH2-N(-)-, cyc-CH(phenyl)-NH-, phenyl-arN, CH3-pyridyl-CH2-"
	C6H3NO	105.0214 	"pyridyl-CO-, -phenyl-NO, ext-arN(C=O)"
	C6H5N2	105.0451 	"phenyl-N=N-, ext-arN2, arN amines"
	C6HO2	104.9976 	"ar/unsatd/cyc; C=O/-O-/-OH"
	C3H5S2	104.9839 	(dithietane)
	C5H3N3 	105.0325 	"ext-arN3, pyridyl-N=N-"
	C4H9O3	105.0551 	"C2H5O-CO-CH(OH)-, (CH3O)3C-, -CH2-CH(OH)-CH(OH)-CH(OH)-, C3 H7O-CO-O-, -CH2OC(OC2H5)O-, C3H7OCH(-O-)O-"
	C5HN2O	105.0087 	"NC-pyrrolidonyl-, ar/ext-ar C=O/-OH/-NH-/-N=N-"
	C3H5O2S	105.0013 	"cyc-CH2CH(-CO-OH)S-, HO-CO-CH2SCH2-, -SCH2CH2-CO-O-"
	C5H10Cl	105.0470 	"Cl(CH2)5-, ClC(C3H7)(CH3)-"
	C4H9OS	105.0377 	C3H7-CO-S-
	C2H2Br	104.9339 	BrCH=CH-
106	C8H10	106.0782 	CH3-phenyl-CH2-
	C7H6O	106.0418 	"cyc-CH(phenyl)-O-, HO-phenyl-CH2-, HO-(CH3-)phenyl-, substd/cyc ketones"
	C7H8N	106.0656 	"CH3-pyridyl-CH2-, (CH3)2-pyridyl-, cyv-CH2N(phenyl)-, ar-amines"
	C6H4NO	106.0292 	"pyridyl-CO-, HO-(CH3-)-pyridyl-, ar(-NH-CO-)"
	C6H6N2	106.0529 	ext-arN2
	C5H4N3	106.0403 	arN3
	C5H2N2O	106.0165 	"arN2O, arN2(C=O)"
	C3H6S2	105.9917 	(CH3S)2CH-
	C4H10O3	106.0629 	-CH2CH(OH)CH(OH)CH(OH)-
107	C7H7O	107.0496 	"CH3O-phenyl-, HO-phenyl-CH2-, cyc-CH(phenyl)-O-, substd/cyc/unsatd C=O/-OH ketones"
	C8H11	107.0860 	polyunsatd/cyc hc
	C6H3O2	107.0133 	"ar/unsatd/cyc; C=O/-O-/-OH"
	C6H5NO	107.0370 	"ON-phenyl-, CH3-pyrrole-CO-"
	C7H9N	107.0734 	"CH3-phenyl-NH-, phenyl-N(CH3)-, cyc/unsatd amines"
	C5H5N3	107.0481 	ext-arN3
	C6H7N2	107.0607 	"-NH-phenyl-NH-, (CH3)2-pyrazinyl-"
	C2H4Br	106.9496 	BrCH(CH3)-
	C5H3N2O	107.0244 	ext-arN2(C=O)
108	C7H8O	108.0575 	"phenyl-CH2O-, HO-phenyl-CH2-, CH3-phenyl-O-, CH3O-phenyl-, phenyl-O-Y*-CH3; (Y* = -CO-O-), cyc/substd/unsatd; C=O/-O-/HO-"
	C8H12	108.0938 	polyunsatd/cyc hc
	C6H4O2	108.0211 	"(HO-)2phenyl-, cyc/subtd/unsatd/ar C=O/-O-/HO-"
	C6H6NO	108.0448 	"CH3O-pyridyl-, H2N-phenyl-O-, -NH-phenyl-O-, substd/cyc -NH-CO-/-OH/-O-"
	C7H10N	108.0812 	cyc/substd/unsatd amines
	C6H8N2	108.0686 	"(CH3)2-pyrazinyl-, phenyl-NHNH-, arN-NH-"
	C5H4N2O	108.0322 	-N-ar-NH-CO-
	C5H2NO2	108.0084 	"-O-ar-NH-CO-, O2N-ar"
	C5H6N3	108.0559 	"pyridyl-NHNH-, H2N-(CH3-)pyrimidinyl-"
	C4H2N3O	108.0195 	H2N-pyrimidinyl-O-
	C4H4N4	108.0433 	ext-arN4
	C6H4S	108.0037 	arS
	C6H5P	108.0129 	ar-P
109	C8H13	109.1017 	polyunsatd/cyc hc
	C7H9O	109.0653 	"1-decalones, cyc/substd/unsatd ketones "
	C6H5O2	109.0289 	"HO-phenyl-O-, CH3-furyl-CO-"
	C6H7NO	109.0526 	"-O-pyridyl-CH2-, CH3O-pyridyl-, H2N-phenyl-O-, HO-phenyl-NH-"
	C7H11N	109.0890 	"cyc/unsatd; imines/amines"
	C5H3NO2	109.0163 	"ar-NO2, arN-CO-OH, -O-ar-NH-CO-"
	C6H5S	109.0152 	phenyl-S-
	C5H5N2O	109.0400 	CH3-pyrimidinyl-O-
	C5HO3	108.9925 	-O-ar-O-CO-
	C4H3N3O	109.0274 	H2N-CO-imidazolyl
	C3H3Cl2	108.9611 	
	C6H9N2	109.0764 	arN-NH-
	C5H7N3	109.0637 	(H2N-(CH3)-pyrimidinyl
110	C7H10O	110.0731 	substd/cyc/unsatd ketones 
	C8H14	110.1094 	substd/cyc/unsatd hc
	C7H12N	110.0968 	"substd/cyc amines, NC-C6H12- "
	C6H6O2	110.0367 	"HO-phenyl-O-, (HO)2-phenyl-, substd/cyc; (C=O)2/C=O/-O- "
	C6H8NO	110.0605 	"oxazoles, cyc/substd/unsatd C=O/N/-CO-N-/C=N-OH, ar-CO-NH-"
	C5H4NO2	110.0241 	"pyrrolinedione-CH2-, maleimidyl-CH2-, cyc C=O/-N-CO-/-O-"
	C5H2O3	110.0003 	ar C=O/-O-/-CO-O-
	C5H6N2O	110.0478 	arN2-O-
	C6H10N2	110.0842 	
	C6H6S	110.0193 	phenyl-S-
	C4H4N3O	110.0352 	N2ar(C=O)-NH2
	C4H2N2O2	110.0114 	pyrazine-(-O-)2-
	C6H3Cl	109.9923 	Cl-phenyl-
	C2H7O3P	110.0132 	(CH3O)2-P(=O)-
111	C8H15	111.1173 	(CH3)2-cyclohexyl- 
	C7H11O	111.0809 	"cyclohexyl-CO-, C4H9CH=CH-CO-, substd/cyc/unsatd; -CO-/-O-/-OH "
	C6H7O2	111.0445 	"-CO-C4H8-CO- (adipates), CH3O-CO-CH=CHCH=CH-, cyc/unsatd; C=O/(C=O)2/-O-/-OH, ar-(OR)2"
	C6H9NO	111.0683 	"cyc/unsatd; amines/imines/C=O/-O-"
	C7H13N	111.1047 	"substd/cyc/unsatd; amines, NC-C6H12-"
	C5H3O3	111.0082 	"HO-pyrone-, furanoate, -CO-C(OH)=C(CH3)-CO-"
	C6H7S	111.0271 	"(CH3)2-thiophenyl-, thiophenyl-CH(CH3)-, ar-S-"
	C5H5NO2	111.0319 	"pyrollyl-CO-O-, H2N-CO-C(CH3)=CH-CO-, ar-OCH2-CO-NH- "
	C5H7N2O	111.0556 	"cyc-carbamate, arN2-OH"
	C6H11N2	111.0920 	"ar-N=CHN(CH3)2, cyc imines"
	C6H4Cl	111.0001 	Cl-phenyl-
	C4H3N2O2	111.0193 	-NH-CO-NH-CO-
	C4H5N3O	111.0430 	HO-arN2-NH2
	C3H5Cl2	110.9767 	
	C2HOCl2	110.9403 	"Cl2CH-CO-, -CCl2-CO-"
112	C8H16	112.1251 	"H-C8H16-Y*, H-C8H16-R-Y* "
	C7H12O	112.0887 	"2-R-cyclohexanone-CH3, R-(CH2)6-CO-Y, C3H7CH=CH-CO-CH2-, cyc/subst/unsatd -CO-/-O-/-OH"
	C6H8O2	112.0524 	"furyl-CH(OCH3)-, cyc; diketones, cyc/substd/unsatd; -CO-O-/-CO-OH/-O-"
	C7H14N	112.1125 	"cyc/substd/unsatd; amines (cyclohexyl-NH-CH2-)"
	C6H10NO	112.0761 	"cyc-CH2CH(N(C2H5)-CO-CH3)-, lactams, other cyc/unsatd amides, cyc HO-N=CH-, OCN-C5H10-"
	C5H4O3	112.0160 	"furyl-CO-O-, ar(C=O)-CO-OH, HO-CO-C(CH3)=CH-CO-, ketoesters"
	C5H6NO2	112.0397 	ketoamides
	C5H6NS	112.0223 	arNS
	C6H12N2	112.0998 	"-N=N-, aminoimines"
	C5H8N2O	112.0635 	aminoamides
	C6H8S	112.0350 	CH3-thiophenyl-CH2-
	C4H4N2O2	112.0271 	-CH(-)-CO-NH-CO-NH-CH(-)-
113	C8H17	113.1329 	satd hc
	C7H13O	113.0966 	"C6H13-CO-, cyc-CH(OH)CH2CH(C3H7)-, -(CH2)6-CO-, CH3O-cyclohexyl-"
	C6H9O2	113.0602 	"CH3O-CO-CH=CH-CH2CH2-, C3H7-CO-CH2-CO-, -CH(OH)-(CH2)4-CO- "
	C5H5O3	113.0238 	"furyl-CO-O-, CH3O-CO-CH=CH-CO-, cyc C=O/-OH/-O- "
	C6H11NO	113.0839 	"cycC=N-OH, pyrrolidinyl-CO-CH2-, cycN -OH/-O-"
	C6H9S	113.0428 	thiabicycloalkane 
	C5H7NO2	113.0475 	"NC-CH(CH3)-CO-O-CH2-, CH3-succinimidyl-, glutarimidyl-"
	C7H15N	113.1203 	cycN
	C8H3N	113.0264 	ext-arN
	C6H13N2	113.1077 	cycN2
	C5H9N2O	113.0713 	pentanolactam-NH-
	C5H7NS	113.0301 	CH3-thiazolyl-CH2-
	C4H5N2O2	113.0349 	cyc(-N-CO-N-CO-)
	C4HO4	112.9874 	cyc-CH(-CO-O-)-CH(-CO-O-)-
	C5H5OS	113.0064 	"CH3O-thiophenyl-, CH3S-furyl-, ar-SO-"
114	C6H10O2	114.0680 	"cyc-CH(-CH2-)(CH2)3-CO-O-, CH3O-CO-CH=C(CH3)CH2-, CH3O-CO-C4H8-Y* "
	C7H16N	114.1281 	(C3H7)2NCH2-
	C5H6O3	114.0316 	HO-CO-(CH2)3-CO- 
	C6H12NO	114.0917 	"CH3-CO-NH-CH(C3H7)-, C4H9-COCH(-)NH-, C4H9N(CH3)-CO-"
	C7H14O	114.1044 	C5H11-CO-CH2-
	C5H8NO2	114.0554 	CH3-CO-CH2-N(-CO-CH3)-
	C6H14N2	114.1155 	C2H5-imidazolidinyl-CH2-
	C4H6N2O2	114.0427 	-CH(-)-CO-NH-CO-NH-CH(-)-
115	C9H7	115.0547 	
	C6H11O2	115.0758 	"CH3O-CO-(CH2)4-, C3H7CH=CH-CO-O-, CH3O-CO-CH2C(CH3)2-,  (CH3)2-1, 3-dioxanyl-"
	C5H7O3	115.0394 	"CH3O-CO-CH2CH2-CO-, C2H5O-CO-CH2-CO-, CH3-CO-CH(-)-CO-OCH2-, -CO-CH2CH(CH3)-O-CO-"
	C7H17N	115.1359 	C3H7NHCH(C3H7)-
	C8H5N	115.0421 	"ext-arN (indolyl-), pyrrolyl-ar"
	C7H15O	115.1122 	"C6H13CH(OH)-, C5H11OCH(CH3)-, (CH3)3C-O-Y*-C(CH3)2-"
	C8H3O	115.0184 	"ext-ar(-CO-CH2-), ext-ar-CO-"
	C7H3N2	115.0295 	indazolyl-
	C6H11S	115.0584 	cyc-CH2CH2CH(SC3H7)-
	C5H9NO2	115.0632 	cyc-N(-CH2CH(-)CH3)-CO-OCH2-
	C6H13NO	115.0996 	(C2H5)2N-CO-CH2-
	C4H5NO3	115.0268 	cyc-C(OH)(CH3)-CO-NH-CO-
	C4H3O4	115.0031 	HO-CO-CH2-C(-)(-CO-OH)-
	C5H9NS	115.0458 	SCN-(CH2)4-
116	C9H8	116.0626 	"phenyl-C3H3(-)-, ext-ar"
	C8H6N	116.0499 	"indolyl, ext-arN, NC-phenyl-CH2-, phenyl-arN"
	C5H8O3	116.0473 	"CH3O-CO-CH2-CO-CH2-, CH3O-CO-CH(-CO-CH3)-, CH3O-CO-CH2-CO-CH(-)-"
	C8H4O	115.9898 	"ext-ar(C=O), ext-ar-CO-"
	C6H12O2	116.0836 	"CH3O-CO-CH(C3H7)-, -C(C2H5)2-CO-O-, C3H7O-CO-CH(CH3)-, (C2H5O)2C(CH3)-"
	C7H4N2	116.0373 	"ext-arN2 (benzimidazoles), phenyl-arN2 "
	C5H10NO2	116.0710 	CH3O-CO-CH2CH2CH(NH2)-
	C4H4O4	116.0109 	"(HO)2-ar(-O-CO-), CH3O-CO-C(-)2-CO-O-"
	C4H6NO3	116.0346 	-C(CH3)(OH)-CO-NH-CO-
	C4H4S2	115.9761 	"thiophenyl-S-, arS2"
	C4H8N2O2	116.0584 	-CH2NH-CO-CH2NH-CO-
	C4H8O2Si	116.0193 	(CH3)3SiO-CO-
117	C9H9	117.0704 	"CH2=CH-phenyl-CH2-, phenyl-CH=CH-CH2-, indanyl-"
	C8H7N	117.0577 	"CH3-phenyl-CH=N-, ext-arN, cyc-CH2CH(-)-N(phenyl)-, phenyl-arN"
	C8H5O	117.0340 	"ext-ar(C=O), HO-ext-ar, ext-ar-CO-"
	C5H9O3	117.0551 	"-CH2O(CH2)3-CO-O-, CH3O-CO-CH2-CO-CH2-, -CH(-CHO-)-OC(CH3)2-O-, CH3O-CO-CH2CH(OCH3)-"
	C7H5N2	117.0451 	"ext-arN2, phenyl-arN2"
	C6H13O2	117.0915 	"C5H11-CO-O-, CH3OCH(CH3)CH(CH3)CH(OH)-, -CH2O-(CH2)4-OCH2-, C3H7OCH(OC2H5)-"
	C6H13S	117.0741 	C4H9SCH(CH3)-
	C5H13OSi	117.0635 	"(CH3)3SiOCH(CH3)-, C3H7OSi(CH3)2-"
	CCl3	116.9064 	
	C7H3NO	117.0214 	"ext-arN(C=O), ext-arN-CO-"
	C5H9OS	117.0377 	"CH3-1, 3-oxathiane"
	C2HF3Cl	116.9718 	CF3C(-)Cl-
118	C9H10	118.0782 	"phenyl-C3H5(-)-, tetralins, -CH2-phenyl-C2H4-"
	C8H8N	118.0656 	"phenyl-cyc-amine; (-CH(CH3)-N(phenyl)-), phenyl-C(=NCH3)-, phenyl-CH=NCH2-"
	C8H6O	118.0418 	"phenyl-CH2-CO-, -CH(phenyl)-CH(-)-O-, ext-ar(-CO-CH2-) "
	C7H6N2	118.0529 	"ext-ar-N2, phenyl-arN2, phenyl-C(-N-)=N-"
	C7H4NO	118.0292 	"cyc-N(phenyl)-CO-, -phenyl-CH=N-O-, HO-ext-arN, o-H2N-CO-phenyl-"
	C7H2O2	118.0054 	"ext-ar(C=O)-O-, ar-CO-O-, ar-(C=O)2-"
	C6H4N3	118.0403 	ext-arN3
	C5H10O3	118.0629 	"HO-CO-C(OH)(C3H7)-, C4H9O-CO-O-, HOC3H6O-CO-CH2-"
	C6H2N2O	118.0165 	NC-pyridyl-O-
	C4H6O4	118.0265 	HO-CO-C(-)(CH3)-
	C4H8NO3	118.0503 	"cyc-CH(OH)-CH(OH)-N(CH3)-CO-, H2N-CO-OCH2CH(OH)CH2-"
	C5H12NO2	118.0867 	"C4H9NH-CO-O-, C4H9O-CO-NH-"
119	C9H11	119.0860 	"phenyl-C(CH3)2-, (CH3)3-phenyl-"
	C8H7O	119.0496 	"CH3-phenyl-CO-, dihydrobenzofurans, -CH2CH(phenyl)-O-, substd/cyc/unsatd ketones "
	C7H5NO	119.0370 	"H2N-phenyl-CO-, phenyl-NH-CO-, cyc-N(phenyl)-CO-, ext-ar(-NH-CO-) "
	C7H3O2	119.0133 	"ar(C=O)2, -phenyl-CO-O-, phenyl-ar(-O-CO-)"
	C8H9N	119.0734 	"benzo-NHCH2-, phenyl-CH=N-CH2-, phenyl-CH2CH(NH2)-, cyc-CH2CH(phenyl)N(-)- "

146	C10H10O	146.0731	"(CH3)3phenyl-CO-, phenyl-CH=CH-CO-CH2-, benzocyclohexanones, cyc-C(C2H5)(phenyl)-CO-"			
	C10H12N	146.0968	"benzo-cycN, -CH(-CH2phenyl)NHCH(CH3)-"			
	C11H14	146.1095	ar/cyc/unsatd hc			
	C9H8NO	146.0605	"HO-benzopyrrolyl-CH2-, phenyl-CH2CH(-)NH-CO-"			
	C9H6O2	146.0367	"HO-phenyl-CH=CH-CO-, phenyl-CH=C(-CO-OH)-, ext-ar(C=O)2, cyc-CO-C(-)(phenyl)-CO-"			
	C8H6N2O	146.0478	"ext-arN2-O-, ext-arN2(C=O)"			
	C8H4NO2	146.0241	"o-CO-phenyl-NH-CO-, ext-arN(C=O)2, HO-CO-benzopyrrolyl, HO-ext-arN(C=O)"			
	C9H10N2	146.0842	"(CH3)2N-phenyl-CH=N-, benzo-cycN2-, H2NCH2-ext-arN"			
	C8H8N3	146.0716	ext-arN3			
	C6H10O4	146.0578	(HO-CO)2-C(C3H7)-			
147	C11H15	147.1173	"(CH3)2phenylC(CH3)2-, (CH3)5phenyl"			
	C9H7O2	147.0445	"phenyl-CO-CH2-CO-, HO-phenyl-CO-CH=CH-, CH3O-benzofuryl-"			
	C10H11O	147.0809	"(CH3)3-phenyl-CO-, CH3O-phenyl-CH2CH=CH-, phenyl-CH2CH(-)CH(OCH3)-, substd/cyc/unsatd ketones"			
	C8H7N2O	147.0556	"oxazolyl-NHCH2-, H2N-NH-(CH3-)phenyl-CO-, CH3O-ext-arN2 "			
	C9H9NO	147.0683	"(CH3)2phenyl-NH-CO-, -phenyl-CO-CH2CH(NH2)-, cyc-CH(CH3)-N(phenyl)-CO-"			
	C10H13N	147.1047	(C2H5)2N-phenyl-			
	C5H15Si2O	147.04	rearr; >=2 (CH3)3SiO-groups			
	C8H5NO2	147.0319	ext-ar(-CO-N-CO-)			
	C9H11N2	147.092	"(CH3)2N-CH=N-phenyl-, ext-arN2 amines"			
	C8H3O3	147.0082	-O-benzo-cyc-CH2O-CO-			
	C7H3N2O2	147.0193	ext-arN2(C=O)-CO-			
	C9H7S	147.0271	benzothiophenyl-CH2-			
	C7H5N3O	147.043	ext-arN3(C=O)			
	C7H7N4	147.0667	ext-arN4			
148	C11H16	148.1251	(CH3)4-phenyl-CH2-			
	C9H8O2	148.0524	"CH3O-CO-CH2-phenyl-, -phenyl-CH2-CO-OCH2-, HO-phenyl-CH=CH-CO-O-"			
	C9H10NO	148.0761	"phenyl-CO-NHCH(CH3)-, (CH3)2N-phenyl-CH(OH)-"			
	C10H12O	148.0887	"phenyl-CH2CH2-CO-CH2-, cyc/unsatd/ar C=O/-O-/-OH"			
	C8H4O3	148.016	"HO-CO-phenyl-CO-, -CH2-(HO-)phenyl-CO-O-"			
	C8H6NO2	148.0397	"pyridyl-CO-CH2-CO-, HO-CO-CH2-pyridyl-, HO-N=CH-CH2-phenyl-O-"			
	C8H8N2O	148.0635	H2N-NH-(CH3-)phenyl-CO-			
	C10H14N	148.1125	"arN, phenyl amines"			
	C9H12N2	148.0998	phenyl diamines			
	C7H4N2O2	148.0271	O2N-phenyl-CH=N-			
	C6H2N3O2	148.0145	ext-arN3(C=O)-O-			
	C6H4N4O	148.0382	ext-arN3-NO			
	C7H8N4	148.0746	"ext-arN4, (CH3)2N-ext-arN3"			
	C6H6N5	148.062	purine-NH-CH2-			
	C8H10N3	148.0872	phenyl-NHC(=N-NHCH3)-			
	C6F4	147.9936	tetrafluorophenyl			
149	C11H17	149.1329	polyunsatd/cyc hc			
	C9H9O2	149.0602	"phenyl-CH(OH)CH2-CO-, ar C=O/-O-/-OH "			
	C8H5O3	149.0238	"phthalates, HO-CO-phenyl-CO-"			
	C10H13O	149.0966	cyc/substd/unsatd/ar C=O/-OH/-O-			
	C8H7NO2	149.0475	"ON-CH2-phenyl-CO-, arN-CH2-CO-O-"			
	C9H11NO	149.0839	ar -O-/amines			
	C10H15N	149.1203	arN			
	C7H5N2O2	149.0349	ar			
	C9H13N2	149.1077	"C2H5NH-phenyl-NHCH2-, pyrazines"			
	C6H3N3O2	149.0223	ext-arN3(C=O)2			
	C8H7NS	149.0301	benzothiazole-CH2-			
150	C12H6	150.0469	ext-ar hc			
	C9H10O2	150.068	"phenyl-CH(-CO-OCH3)-, cyc/unsatd/ar C=O/-OH/-O-"			
	C7H4NO3	150.019	"O2N-phenyl-CO-, -O-phenyl-O-CO-NH-"			
	C10H14O	150.1044	"cyc/unsatd ketones, phenyl -O-/-OH"			
	C8H6O3	150.0316	phenyl -CO-O-/-OH/CH3-/-CO-OH/-O-			
	C8H8NO2	150.0554	"CH3O-CO-NH-phenyl-, ar/cyc/unsatd amines/-CO-O-/C=O/-O-/-CO-NH-"			
	C10H16N	150.1281	cyc/substd amines			
	C7H6N2O2	150.0427	"HO-CO-ext-arN2, ON-phenyl-NH-CO-"			
	C9H12NO	150.0918	(CH3)2N-(HO-)(CH3-)phenyl-			
	C5H2N4O2	150.0174	O2N-ext-arN3			
	C7H6N2S	150.0253	ext-arNS-NH-			
	C3F6	149.9904				
	C6H2N2O3	150.0063	O2N-(-N-CO-)2-ar-	"Note: The computer-aided correlations were carried out only for data from m/z 29 to m/z 150, inclusive."		
151	C2Cl2F3	150.9329				
	C9H11O2	151.0758	(HO)2phenyl-C(CH3)2-			
	C8H7O3	151.072	"(CH3O)2phenyl-CH2, CH3O-(HO)-phenyl-CO-, CH3O-CO-phenyl-O-"			
			"ICC-, CH2-CH-(CH3-)(Cl-)phenyl-, monoterpenones, C12H7 "			
152	C12H8	152.0626	"-phenyl-phenyl-, phenyl-CH(-)-phenyl"			
			"CH3O-C7H5O2, O2N-(HO-)phenyl-CH2-, CH2=CH-CO-N (cyclohexyl)-, Cl-benzoxazolyl-, aporphine alkaloids"			
153	C9H10Cl	153.0471	Cl-phenyl dvts			
	C12H9	153.0704	"phenyl-phenyl-, naphthyl-CH=CH-"			
			"BrC2H4-CO-O-, (CH3O)2-phenyl-O-, CH3O-phenyl-CO-O-, thiophenyl-CO-CH2-CO-"			
154			"H-CO-NH-(Cl-)phenyl-, (phenyl)2SiCl2, CF3-CO-N(C2H5)CH2-, HO-(Cl-)(R-)phenyl-"			
155			"Cl-(R-)phenyl-O-, Br-phenyl-, HO-(Cl-)phenyl-CO-, (C2H5O-)2, P(=O)O-, C4H9O-P(=O)(-O-)2, C3H381BrCl, C5F5, C3H2BrF2, phenyl-(CH3O-)PO-, naphthyl-CO-, CH3-phenyl-SO2-, C4H9O-CO-C2H2-CO-, (pyridyl)2-, CH3-naphthyl-CH2, C11H23"			
156			"C8H17N(CH3)CH2-, CH3-quinolinyl-CH2-, quinolinyl-CH2CH2-, Br-pyridyl-, (C4H9)2N-CO-"			
157	C3H581BrCl	156.9244				
	C3H4BrF2	156.9465	"(C3H7)3Si-, CH3-phenyl-pyrazole-"			
158	C11H12N	158.0969	(CH3)2-indole-CH2-			
	C12H14	158.1095	-phenyl-cyclohexyl-			
159	C7H5Cl2	158.9768	"Cl2-phenyl-CH2-, phenyl-CCl2-"			
			"C12H15, C6H8Br, CHFI"			
160			"C2BrF3, CH3O-indole-CH2-, -Cl2-phenyl-O-"			
161	C12H17	161.1329	"CH3-benzothiophene-CH2-, BrC6H10-, C3H5-, CO-N(phenyl)-"			
162	C6H4OCl2	161.9639	Cl2-phenyl-O-			
			"phenyl-N(C4H9)-CH2-, phenyl-N(-CO-CH3)CH(CH3)-"			
163	C3Cl2F3	162.9329				
	C11H15O	163.1122	"C10H11O2, C9H7O3, C12H19, C81BrCl2, (C2H5O)3Si-, C4H4ClF4, C3OClF4, C10H13ON"			
164			"C6H11-C6H9-, C3H5-(CH3O-)phenyl-O-, H-CO-(CH3O-)phenyl-O-, -fluorene-, berbines"			
165	C13H9	165.0704	"phenyl-CH(-)-phenyl-, -(CH3-)phenyl-phenyl-"			
			"C10H13O2, C9H9O3, aporphine alkaloids, BrCH2-CO-OCH(CH3)-, Cl-phenyl-CH=CH-CO-, Cl-benzofuran-CH2-, (C2H5O)2P(=O)C2H4-, C5Cl3"			
166	C13H10	166.0782	(phenyl)2-C(-)-			
			"C2Cl337Cl, -(C3H5-)(Cl-)phenyl-O-, carbazole-, O2N-(HO-)phenyl-CO-, phenyl(-CO-O-)2, Cl-phenyl-N(C3H5)-"			
167	C2Cl3F2	166.9034				
	C13H11	167.086	"(phenyl)2-CH-, phenyl-CH2-phenyl-, acenaphthenes"			
			"Cl-phenyl-N(-CH2CH=CH2)-, C10H12Cl, Cl-(HO-)phenyl-, C3H4-, phenyl(-CO-O-)2"			
168			"-phenyl-O-phenyl-, (phenyl)2-N-, C9H9OCl, O2N-phenyl-O-, C8H8O4, phenyl-NH-CO-, (phenyl)2CH-"			
169	C12H9O	169.0653	"phenyl-phenyl-O-, phenyl-O-phenyl-, HO-(phenyl)2-"			
	C7H6Br	168.9653				
	C9H10OCl	169.042	"(phenyl)2N-, Cl-phenyl-Si(CH3)2-, naphthyl-C3-, Cl2C2H3-CO-OCH(CH3)-, C3H5O-CO-C4H8-CO-, Cl-terpenoles, C3F7, ClCH2-CO-N(phenyl)-, C12H25, -(Br-)(HO-)phenyl-"			
170	C12H10O	170.0731	phenyl-phenyl-O-			
			"(C5H11)2NCH2-, Br-phenyl-NH-, (pyridyl)2N-, C3H7-(Cl-), phenyl-O-"			
171	C8H5Cl2	170.9768	"-(Cl2-phenyl)-CH(-)CH2-, Cl2-phenyl-CH=CH-"			
	C12H11O	171.0809	phenyl-phenyl-O-			
			"-CO-C7H14-CO-O-, F-phenyl-phenyl-, C5ClF4, CH3O-phenyl-SO2-"			
172	C6H5OBr	171.9524	Br-phenyl-O-			
	C8H6Cl2	171.9846	-Cl2-phenyl-C2H3-			
173	C8H7Cl2	172.9924	"CH3-(Cl2-)phenyl-CH2-, Cl2-phenyl-CH(CH3)-, Cl2-phenyl-CH2CH2-"			
			"Cl2-phenyl-CO-, C13H17, CHBr81Br, C2H5-CO-OCH2CH(-O-CO-C2H5)-"			
174			"CH2=CHCH2N(-CO-CH3)phenyl-, HBr81BrC-"			
175	C7H5OCl2	174.9717	"Cl2-phenyl-CH(OH)-, Cl2-(HO-)phenyl-CH2-, Cl2-(HO-)(CH3-)phenyl-, Cl-phenyl-OCH2-"			
	C13H19	175.1486	"Rn-phenyl, perhydropyrene"			
			"C4Cl2F3, phenyl-Si(Cl)2-, H2C=C(Cl)CH2O-CO-C2H4-CO-, C12H15O"			
176	C12H16O	176.1201	cyclohexyl-phenyl-O-			
177	C12H17O	177.1279	"C4H9-(HO-)phenyl-CH(CH3)-, C4H9-(CH3O-)phenyl-CH2-"			
			"C2H281BrCl2, C2H5O-CO-phenyl-CO-, C6H10OBr, CF2I"			
178	C14H10	178.0782	"dihydroethanoanthracene, -(phenyl)2-C2-"			
			"C3Cl337Cl, HO-phenyl-N(C4H9)CH2-, phenyl-CH(CH3)N(C2H4OH)CH2-"			
179	C3Cl3F2	178.9034				
	C14H11	179.086	(phenyl)2-C2H-			
			"C2BrF4, CH3O-CO-C3H5Br-, C2H81BrClF2, C3HCl337Cl, C11H15O2, Cl3-phenyl-"			
180	C9H10NO3	180.066	O2N-(HO-)phenyl-C(CH3)2-			
	C14H12	180.0938	"CH3-phenyl-CH2-phenyl-, C2H5-(phenyl-)2-, CH3-(phenyl-)2CH-, -(phenylCH-)2-"			
181	C4F7	180.9888	"phenyl-phenyl-CH(CH3)-, Cl(CH3H7-)phenyl-CH(CH3)-, phenyl-phenyl-NO-"			
182			"(Phenyl)2NCH2-, (O2N)2-phenyl-NH-, phenyl-CH2-phenyl-NH-"			
183	C7H4BrO	182.9446	Br-phenyl-CO-			
	C8H8Br	182.981	Br-phenyl-CH(CH3)-			
	C13H11O	183.0809	"phenyl-O-phenyl-CH2-, CH3O-(phenyl)2-, phenyl-CH2-phenyl-O-, (phenyl)2-O-CH2-"			
			"(phenyl)2SiH-, CF3SSCF2-"			
184			"phenyl-CH2-phenyl-O-, C12H26N, (O2N)2phenyl-O-, H2N-(Br-)phenyl-, -ON-phenyl-CO-CH2-"			
185			"C4H9O-CO-C4H8-CO-, C2Cl337ClF, -Cl-phenyl-OCH2-CO-O-, C3ClF6, C2HBr81Br, Br-(HO-)(CH3-)phenyl-"			
186			"phenyl-O-phenyl-O-, C4H9O-CO-C4H8-CO-, C2H2Br81Br, -Cl-(phenyl)2-"			
187			"C14H19, Cl2-phenyl-C(CH3)2-, C2H3Br81Br"				
189	C14H12	189.1642	"C8H7OCl2, C13H17O, CH2=CHCH2O-CO-phenyl-CO-"				
190			"Cl-(O2N-)phenyl-, NC-fluorene-"				
191	C15H11	191.086	"anthracene-CH2-, phenanthrene-CH2-"				
	C14H23	191.1799	tetradecahydroanthracene-				
	C13H19O	191.1435	"C4Cl3F2, C3H6ClO-SiCl2-, C3BrF4, CBr81BrF, C4HCl337Cl, C3H481BrCl2, C4ClF4S, 81BrCl-phenyl-, C2H2F2I, C3H7O-CO-phenyl-CO-"				
192			"CH3O-phenyl-N(C4H9)CH2-, -Cl2-phenyl-CCl(-)-"				
193			"C15H13, Cl3-phenyl-CH2-, (C2H5O)3SiOCH2-, C12H17O2, C2H5O-CO-C3H5Br-, trimellitic anhydride esters"				
194			"C4Cl2F4, C2H5O-CO-phenyl-CO-O-, -(Cl3-)(HO-)phenyl-"				
195			"C15H15, Cl3-phenyl-O-, CH3-phenyl-CO-phenyl-, (CH3)2-phenyl-O-P(=O)(-O-phenyl-CH3), C12H16Cl, CF3-phenyl-CF2-, Br-phenyl-C3H3-"				
196			"Cl3-phenyl-O-, phenyl-CH2N(phenyl)CH2-, phenyl-(CH3-)-2-pyridonyl-"				
197			"Br-phenyl-C(CH3)2-, C281BrClF3, HO-phenyl-CO-phenyl-, HO-(O2N-)2phenyl-CH2-, CH3-phenyl-O-CH2-, C4ClF6, C4H9-(Cl-)phenyl-O-CH2-, Br-CO-C2H381Br-, (phenyl)2Si(CH3)-, C15H17"				
198			"(C6H13)2NCH2-, HO-(O2N- )2phenylCH2-, (CH3)2N-CO-NH-(Cl-)phenyl-"				
199			"C3H3Br81Br, Br-(HO-)phenyl-CO-, Cl2-benzofuran-CH2-, C3HCl3F3"				
200			"-Cl-(CH3-)(phenyl)2-, Y*-C3H4Br81Br-"				
201			"C3H5Br81Br, C2HOBr81Br, Cl-phenyl-CH2-phenyl-, C3Cl2F5, C2Cl437Cl, (C4H9)2(CH3)2Si2H-, C16H9"				
202			"Hg, -(Cl-)phenyl-O-phenyl-, Cl2-ext-ar-OCH3"				
203			"Cl2(CH3)3-phenyl-O-, Cl-phenyl-O-phenyl-, Cl-(HO-)phenyl-phenyl-, Cl-phenyl-phenyl-O-, C15H23 (B/C/D rings of cholestane)"				
204			"phenanthrene-cyc hc, C4H581BrCl2, TMS dvts of pyranosides "				
205			"phenyl -O-/-OH, sesquiterpenones, C7H581BrCl, C4H9O-CO-phenyl-CO-, C6F7, C2H5O-C6H9Br-, Br-phenyl-CF2-, Br-naphthyl-"				
206			"C4H9-(C3H5O-)phenyl-O-, Cl3-phenyl-CH(-)CH2-"				
207			"phenyl C=O/-O-/-OH, Cl3-phenyl-CH(CH3)-, methysiloxanes, CBr81BrCl, C16H15"				
208	Pb	207.9766	"OCN-phenyl-CH2-phenyl-, phenyl-phenyl-OC3H3-"				
209			"R-(Cl-)phenyl, C12H14C1O, C4Cl337ClF, C15H13O, CH3-(phenyl-CO-phenyl)-CH2-, Cl3-(HO-)-phenyl-, C381BrClF3, C3H7O-CO-phenyl-CO-O-"				
210			O2N-phenyl-CH=CCl-CO-				
211			"HO-phenyl-phenyl-C(CH3)2-, HO-(O2N-)2phenyl-CH(CH3)-, C3HBrF5, (C4H9O)2P(=O)O-, C2H81BrCl3, C4HCl3F3, phenyl-phenyl-Si(CH3)2O-, C5H11-naphthyl-CH2-"				
212			"C3H5-(Br-)phenyl-O-, phenyl-O-phenyl-C3H6-"				
213			"C4Cl2F5, HO-(Br-)phenyl-C(CH3)2-, C3Cl437Cl, C281BrCl2F2, C4H5Br81Br, (CF3)2-phenyl-, Cl(phenyl)2-CH=CH-, -5-(HO-) steroid A/B/C rings, C6H13O-CO-C4H8-CO-"				
215			"C16H23:Y*-steroid A/B/C rings, C4H7Br81Br, Cl2-(C2H5-)2phenyl-CH2-, Cl381Cl-phenyl-, CH3-benzanthracenyl-"				
217			"C16H25:steroid A/B/C rings, R-phenyl, Cl2-(CH3O-)phenyl-C(CH3)2-, Cl-(CH3O-)phenyl-phenyl-, CH3Hg-, (phenyl-O)2P-, C3Cl3F4, TMS dvts of furanosides "				
218			"I-(HO-)phenyl-, (C4H9)2NCH(phenyl)-"				
219			"C2Br81BrCl, C4F9, -Cl2-phenyl-OCH2-CO-O-, Br-phenyl-SO2-, 81BrCl-phenyl-R-"				
220			"Cl-phenyl-O-phenyl-O-, (CH3)2N-CO-(C4H9-)phenyl-, C4H9-(cyclohexyl)2-"				
221			"C6H17O3Si3, (phenyl)2-C5H7-, Cl2-(phenyl)2-, (H3CO-CO-)2phenyl-CO-, C4ClF6, Cl2-(CH3O-)2phenyl-O-, Cl3-(C2H5-)phenyl-CH2-, phenyl-CO-CH=C(phenyl)CH2-, Cl3-2,3-dihydrobenzofuryl-, Cl2-phenyl-OCH2-CO-O-, C2H2Br81BrCl"				
222			"C4BrF5, C5Cl3F3"				
223			"CH3Pb, C3H7-(phenyl)2-CH(CH3)-, Cl-(C3H7-)2phenyl-CH(CH3)-, C4H9-(O2N-)2phenyl-, C4H9O-CO-phenyl-CO-O-, C4ClF4S2, -(C3H7-)(phenyl)2-CH(CH3)-, Cl3-phenyl-OCH(CH3)-, C10H21-cyclohexyl-"				
224			"-C15H30CH(C5H11)-, C4H9O-(phenyl)2 , C6F8"				
225			"Cl-(C4H9-)(HO)phenyl-C(CH3)2-, C4Cl437Cl, C381BrCl2F2, C5H11-naphthyl-CH(CH3)-, HO-(O2N-)2phenyl-C(CH3)2-,  Br-(C3H7-)phenyl-CH(CH3)-, phenyl-O-CO-phenyl-CO-, phenyl-O-phenyl-C4H8-, C5Cl2F5, C15H31CH(C5H11)-"				
226			"(C7H15)2NCH2-, C18H10, (phenyl)2-O-C3H4(OH)-"				
227			"C18H11-, C4H9-(HO-)(Br-)phenyl-"				
228			"C18H12, -C5H8Br81Br- "				
229			"Cl337Cl-(CH3-)phenyl-, C5H9Br81Br-, C3H81BrClF4, BrHC=C81BrC(OH)(CH3)-, C11H13Si3, Cl3-phenyl-O-Y-37Cl, C4HCl337ClF2, C4Cl3F4, (phenyl)3-, F3CCClFC(CF3)(OCH3)-"				
230			C6H13-CO-N(phenyl)-C3H4-				
231			"(C4H9)2-phenyl-C(CH3)2-, ClC2H4O-(Cl-)phenyl-C(CH3)2-, phenyl-CH(C10H21)-, perhydrobenzanthracene-, ClC3H4O-CO-C2H4-CO-OC3H4-, C2H5Hg-, C5F9, ICH2CH(phenyl)-, Cl337Cl-(HO-)phenyl-"				
233			"disbustd(HO-)steroid A/B/C rings, Cl3-benzofuran-CH2-, (ClC2H4O)2POC2H4-, Br(phenyl)2-, C7ClF6,(phenyl-O)2P(=O)-"				
234			-Br81Br-phenyl-				
235			"(Cl-phenyl)2CH-, C3Cl337ClF3, Br2-phenyl-, ClC3H6O-Si(Cl2)OC2H4-, (cyclohexyl-C2H4-)2CH-, Cl3(C2H5)2-phenyl-"				
236			"HO-(O2N-)phenyl-C7H14-, -(Cl2-)-phenyl-O-phenyl-, CH2=CH-S-(Cl3-)phenyl-Cl3(C3H5)-phenyl-O-, C12H23-(C5H9)-, -(Br2-)(CH3-)(HO-)phenyl-, C7F8"				
237			"C2H5Pb, C8H17-thiophenyl-C(CH3)2-, Cl-(C3H7-)2(CH3-)phenyl-CH(CH3)-, Cl2-phenyl-O-phenyl-"				
238			(CH3)2Pb				
239			"81BrCl3-phenyl-CH2-, C5H11-naphthyl-C3H6-, phenyl-SiH2-phenyl-Si(CH3)2-, C19H11, C17H35, C4H581BrCl3, phenyl-O-phenyl-C5H10-, C15H31-CO-"				
240			"C5Cl337ClF2, C19H12, Cl3-phenyl-OCH2CH2O-"				
241			"Br81Br-cyclohexyl-, C4BrF6, C5Cl3F4, ClC2H4OC2H4O-phenyl-C(CH3)2-, benzophenanthrene-CH2-, 81BrCl2-(HO-)phenyl-, C4H9O-CO-C8H16-CO-, C5HCl337ClF2, CHBr=CBrC(OH)(C2H5)-"				
243			"Cl2-(C2H5-)3-phenyl-CH2-, Cl2CH-phenyl-CCl37Cl-, (phenyl)3C-, Cl3-phenyl-SO2-, C6F9"				
244			(phenyl)2N-phenyl-				
245			"tetrahydronaphthacene-CH2-, perhydronaphthacene-, (CF3CH2O-)2P(=O)-, C3H5O-(C4H9)2-phenyl-"				
247			"Cl337Cl-(HO-)phenyl-O-, C5ClF8, C4Cl337ClF3"				
248			"(C2H5)4-cyc-Si3O3-, -(phenyl)2-C2Cl2-"				
249			"Cl3-(C2H5-)2-phenyl-CH2-, Br81Br-phenyl-CH2-,(ClC3H6O-)2SiCl-, C6Cl437Cl, C3HCl537Cl,(ClC2H4O-)2P(=O)OC2H4-, C7Cl2F5, (OCN-phenyl-)2CH-"				
250			Br81Br-(H2N-)phenyl-				
251			"CBr281Br, trisubstd ketosteroids, Cl-(C4H9-)2phenyl-CH(CH3)-, (phenyl)2-C(CH3)2CH2C(CH3)2-, C3Cl437ClF2, Br81Br-(HO-)phenyl-C6H11CH2CH(C10H21)-"				
253			"(CH3)3Pb, Cl2-phenyl-C2H381Br-"				
254			I2(iodine) 				
255			"C2HBr81BrCl2, CH3-benzanthracene-CH2- "				
256			"C6Cl2F6, S8(255.7766, sulfur)"				
257			"C19H29, Cl337Cl-(C2H5-)phenyl-CH2-"				
259			"Cl537Cl-cyclohexyl, C5Cl337ClF3, C4H381BrCl2F3,  (CH3-)2phenyl-CH(C11H21)-, ClC4H8O-(Cl-)phenyl-C(CH3)2-"				
260			C4Cl537Cl				
261			"C4Cl3F4S, C5HCl3F5"				
262			"-(Br81Br-)phenyl-CO-, C6F10"				
263			"Cl437Cl-phenyl-CH2-, Br81Br-phenyl-CH(CH3)-, C2Br281Br"				
264			"C2HBr281Br, -(CH3-)cyclohexyl-CH(C11H23)-"				
265			"C2H2Br281Br, (C3H7-)2(phenyl)2-CH(CH3)-, C17H33-CO-, C7H13CH(C11H23)-"				
266			"Cl437Cl-phenyl-O-, (CF3)2-triazine-CF2-, CI2"				
267			"C4H9-phenyl-O-phenyl-C(CH3)2-, ClC3H6O-(C4H9-)phenyl-C(CH3)2-, C2H5Pb(CH3)2-, CHI2, C17H35CO-, C4Cl3F6, (naphthyl)2-CH-"				
268			"(C8H17)2N-CO-, C8F9"				
269			"C6H4BrF6, C19H27O(Y*2-hydroxyketosteroid), Br81BrCl-phenyl-, C15H21Si2, C5F11"				
271			"C19H27O(Y2*-diketosteroid, CF3Hg, CF3-(phenyl)2-CF2-, Cl3-phenyl-O-phenyl-"				
272			C5Cl537Cl				
273			"C19H29O(Y*-hydroxysteroid), Br-(CF3-)phenyl-CF2-, C3HBr81BrF4"				
274			C7F10				
275			"C5Cl437ClF2, C4H9-phenanthrenyl-C(CH3)2-, C481BrCl2F4, (CF3CH2O)2P(=O)OCH2-, C4H9O-CO-CH2O-(Cl2-phenyl)-"				
276			-(37Cl-)phenyl-C2Cl4-				
277			"CCl237Cl-phenyl-CCl2-, (C2H5)5-cyclotrisiloxane-, Br81Br-dihydrobenzofuryl-, Br81Br-phenyl-C(CH3)2-, dibenzoanthracenyl-"				
278			-C6H10-CH(C13H27)-				
279			"C3H4Br81Br, naphthyl-CH(C10H19)-, C5HCl337ClF4"				
280			-(C9H18)CH(C10H21)-				
281			"(CH3)7Si4O4-, CH3(C2H5)2Pb, (C3H7-)3(phenyl)2-, C9H5F8O, C6H13-phenyl-O-phenyl-C2H4-, C10H21CH(C9H19)-, Cl437Cl-phenyl-S-, C6F11"				
283			Br81Br-phenyl-CHCl-				
284			C6Cl537Cl				
285			"tetrahydronaphthyl-CH(C10H21)-, C8H2F9O"				
286			"phenyl-Bi-, C8F10"				
287			C14H29CH(phenyl)-				
291			"C5H81BrClF6, decahydronaphthyl-CH(C10H21)-"				
292			Br81BrC3H5-phenyl-O-				
293			"Br81Br-(HO-)phenyl-C(CH3)2-, C4H6Br281Br-(HO-)phenyl-C(CH3)2-, C4H6Br281Br, C7F11, (naphthyl)2C=CHCH2-, (ClC3H6O)2SiCl-OC2H4-"				
294			"Br81Br-(C3H5-)phenyl-O-, -(C10H20)-CH(C10H21)-"				
295			"Cl3-phenyl-OP(=S)37Cl-, C6H13-phenyl-O-phenyl-C3H6-, (C2H5)3Pb-, (C10H21)2CH-"				
297			C5Cl337ClF5				
299			C4H9-pyrene-C(CH3)2-				
301			C2HBr81Br2Cl				
305			C8F11				
307			"(C5H11-phenyl-)2CH-, C5Cl637Cl"				
309			C17H35CH(C4H9)-				
311			Cl3C-(Cl-)phenyl-CCl37Cl-				
312			C7F12				
313			"Br281Br-phenyl-, C5Cl437ClF4"				
315			C3H3Br81Br2Cl				
317			C9F11				
319			"C6Cl637Cl, C6F13"				
324			"(CF3CH2O)2P(=O)OC2HF2(-)-, C8F12"				
325			(HO-)(C4H9-)(phenyl-)2C(CH3)-				
327			"(C4H9O-CO-)2C3H3-CO-OC3H6-, Br281Br-phenyl-CH2-"				
329			C17H35CH(phenyl)-				
331			"C21H23Si2, C7F13"				
337			C21H43CH(C2H5)-				
341			CCBr281Br-phenyl-CH(CH3)-				
343			"Br281Br-(HO-)(CH3-)phenyl-, C8F13"				
345			"C2HBr281Br2, I2-(HO-)phenyl-"				
355			"silicones, C9F13"				
359			C3H3Br281Br2				
367			C10F13				
368			-cholestene-				
369			C7F15				
370			-cholestane-				
381			C8F15				
405			C10F15				
412			C9F16				
417			11F15				
424			C10F16				
429			silicones				
431			C9F15				
436			C11F16				
443			C10F17				
447			C4Br381Br2				
448			C12F16				
455			C11F17				
462			C10F18				
467			C12F17				
469			C9F19				
474			C11F18				
481			C10F19				
486			C12F18				
493			C11F19				
505			C12F19				
512			C11F20				
517			C13F19				
524			C12F20				
531			C11F21				
536			C13F25				
543			C12F12				
555			C13F21				
562			C12F22				
567			C14F21				
574			C13F22				
581			C12F23				
593			C13F23				
605			C14F23				
617			C15F23				
631			C13F25				
643			C14F25				
by member last modified 2006-07-13 10:21

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