| ID | Name | CAS | Data |
McVol (ml/mol) |
| 36-509-7 |
l-Phenylalanine, N-(5-chlorovaleryl)-, methyl ester
|
|
6 | 229.680 |
| 37-191-9 |
Succinic acid, 2-chlorophenyl 3-fluorophenyl ester
|
|
6 | 217.670 |
| 37-266-6 |
L-Alanine, N-(2-trifluoromethylbenzoyl)-, methyl ester
|
|
6 | 180.480 |
| 37-341-2 |
3-Vinyl-1,2-dithiacyclohex-4-ene
|
62488-52-2 |
6 | 108.640 |
| 37-497-0 |
L-Ile, N-ethoxycarbonyl, (S)-1-phenylethylamide
|
|
6 | 255.600 |
| 37-566-3 |
trans-(3-Trifluoromethyl)cinnamic acid, cyclobutyl ester
|
|
6 | 181.950 |
| 37-654-5 |
Dauc-6(14),11-dien-5-ol
|
|
6 | 197.760 |
| 37-869-7 |
2-Ethylbutyric acid, 3,5-dichlorophenyl ester
|
|
6 | 188.100 |
| 37-913-7 |
1-(1-Ethenyl)-cis-2-butyl-cyclopropane
|
|
6 | 122.510 |
| 37-947-0 |
Succinic acid, 4-isopropylphenyl 2-methoxyethyl ester
|
|
6 | 233.290 |
| 38-109-9 |
DL-.beta.-Homophenylalanine, N-dimethylaminomethylene-, ethyl ester
|
|
6 | 221.550 |
| 38-155-8 |
Methylphosphonic acid, methyl 2-(diethylamino)ethyl ester
|
|
6 | 171.630 |
| 38-173-8 |
Isonipecotic acid, N-(3-methylbutyryl)-, octyl ester
|
|
6 | 286.700 |
| 38-524-8 |
Ethyl N-(3-chloro-4-methylphenyl)carbamate
|
85419-40-5 |
6 | 157.660 |
| 38-594-1 |
Isonipecotic acid, N-(3-methylbutyryl)-, tetradecyl ester
|
|
6 | 371.240 |
| 38-820-9 |
«beta»-Alanine, N-(2-methylbenzoyl)-, isohexyl ester
|
|
6 | 245.620 |
| 39-400-4 |
3-Methoxy-1-methyl-1,3-cyclohexadiene
|
98677-97-5 |
6 | 109.990 |
| 39-523-8 |
(S)-2-Methylbutyl glucuronide, methyl ester, triacetate
|
|
6 | 295.120 |
| 39-736-2 |
N-3-(Methylthio)propyl O-ethyl thiocarbamate
|
89855-25-4 |
6 | 153.740 |
| 39-878-5 |
Norbornane, 6-chloro-2-trichloromethyl, endo-Cl
|
|
6 | 150.820 |
| 40-273-4 |
2,4,6-Trichlorobenzyl alcohol, neopentyl ether
|
|
6 | 198.770 |
| 40-311-1 |
Urea, 1-benzyl-1-cyclopropyl-3-methyl-
|
116502-58-0 |
6 | 166.850 |
| 40-880-0 |
1,4,4-Trimethylcyclohex-2-enecarboxylic acid
|
103262-04-0 |
6 | 144.040 |
| 40-976-4 |
2(3H)-Furanone, 5-ethyldihydro-5-methyl-
|
2865-82-9 |
6 | 106.070 |
| 41-400-1 |
Formamidine, 3,3-hexamethyleno-1-(3-ethoxyphenyl)
|
|
6 | 209.120 |
| 41-435-3 |
3,4-Difluorobenzoic acid, 4-cyanophenyl ester
|
|
6 | 172.960 |
| 41-461-4 |
Diethylmalonic acid, 2,3-dichlorophenyl isobutyl ester
|
|
6 | 265.990 |
| 41-552-3 |
2-(3-Pentoxy)-3-methyl-1-butene
|
|
6 | 153.330 |
| 41-799-0 |
2(3H)-Furanone, 5-ethenyldihydro-5-methyl-
|
1073-11-6 |
6 | 101.770 |
| 41-988-0 |
Quinazolin-4-one, 2-methyl-3-propyl
|
|
6 | 162.550 |
| 42-081-5 |
Isonipecotic acid, N-(3-methylbutyryl)-, hexyl ester
|
|
6 | 258.520 |
| 42-209-3 |
Aspartic acid, n-(trifluoroacetyl)-, 1-ethyl ester
|
45203-86-9 |
6 | 155.320 |
| 42-477-6 |
Diethylmalonic acid, 2,3-dimethylphenyl isobutyl ester
|
|
6 | 269.690 |
| 42-787-2 |
Isonipecotic acid, N-(2-trifluoromethylbenzoyl)-, heptyl ester
|
|
6 | 296.430 |
| 42-866-4 |
Diethylmalonic acid, monochloride, 2,3-dimethylphenyl ester
|
|
6 | 219.700 |
| 43-128-2 |
Bis(3,4-bis(phthalamido)phenyl) ether
|
|
6 | 503.170 |
| 43-151-6 |
1H-Indole-2,3-dione, 5-methyl-
|
608-05-9 |
6 | 116.170 |
| 43-316-3 |
Cyclohexene, 1,5-dimethyl-5-(1-methylethenyl)
|
|
6 | 146.390 |
| 43-355-0 |
N'-(2-naphthyl)-N,N-dimethyl-formamidine
|
|
6 | 166.470 |
| 43-415-3 |
Dauca-8(14),11-dien-9-ol
|
|
6 | 197.760 |
| 43-482-9 |
3,6-dihydro-4-methyl-2H-pyran
|
16302-35-5 |
6 | 86.110 |
| 43-700-6 |
Sarcosine, N-(2,6-difluorobenzoyl)-, propyl ester
|
|
6 | 192.800 |
| 43-785-3 |
3-Chloro-2-fluorobenzoic acid, cyclohexyl ester
|
|
6 | 180.860 |
| 43-892-4 |
germacra-1(10),4-dien-6-ol
|
|
6 | 208.620 |
| 44-096-7 |
9-«alpha»-H,10-«beta»-Methyl ergosterol
|
|
6 | 354.910 |
| 44-208-2 |
l-Methionine, N-(2-thienylcarbonyl)-, methyl ester
|
|
6 | 198.080 |
| 44-243-3 |
Abieta-8,11,13-trien-7-one
|
|
6 | 248.750 |
| 44-559-3 |
P-chlorobenzene sulfonic acid, p-chlorophenyl hydrazide
|
|
6 | 204.950 |
| 44-850-9 |
3-Methyl-2-buten-1-ol, heptafluorobutyrate
|
|
6 | 153.200 |
| 45-305-3 |
2(5H)-Furanone, 5-chloromethyl-3-methyl
|
|
6 | 99.920 |
| 45-704-0 |
(4S,7S)-7-isopropyl-4methyloxepane-2-thione
|
|
6 | 158.820 |
| 46-335-9 |
Norbornane, 6-chloro-2-trichloromethyl, exo-Cl
|
|
6 | 150.820 |
| 46-809-3 |
Isonipecotic acid, N-(3-chloropropionyl)-, undecyl ester
|
|
6 | 313.030 |
| 47-166-6 |
Pentanamide, N-(2,5-dimethoxyphenyl)-5-chloro-
|
|
6 | 205.800 |
| 47-175-6 |
Glucose, 2,3,6-triethyl, nitrile, acetylated
|
|
6 | 270.170 |
| 47-236-8 |
Zopiclone-M/artifact (amino-chloro-pyridine) AC
|
|
6 | 119.500 |
| 47-411-3 |
(Z)-1-(2',4',5'-Trimethoxyphenyl)butadiene
|
|
6 | 179.280 |
| 47-541-9 |
2,6,6-trimethylcyclohepta-1,3-diene
|
|
6 | 132.300 |
| 47-547-3 |
Diethylmalonic acid, monochloride, hept-4-yl ester
|
|
6 | 229.370 |
| 47-678-8 |
2-Thenylamine, n-methyl-n-2-propynyl-
|
2322-00-1 |
6 | 135.940 |
| 47-724-6 |
3-Fluoro-4-trifluoromethylbenzoic acid, isopropyl ester
|
|
6 | 156.610 |
| 47-860-5 |
2,6-Diethylaniline, N,N-bis(pentafluoropropionyl)
|
|
6 | 243.360 |
| 47-922-6 |
Isonipecotic acid, N-(5-chlorovaleryl)-, ethyl ester
|
|
6 | 214.400 |
| 48-237-6 |
5-Methyl-2-phenyl-hex-2-enenitrile
|
|
6 | 167.350 |
| 48-353-7 |
cis-Muurola-5-en-4-«beta»-ol
|
|
6 | 202.060 |
| 48-626-4 |
Clomipramine N(HO), acetylated, isomer # 1
|
|
6 | 288.010 |
| 48-948-7 |
N,N-Dimethyl-N'-(3-ethoxyphenyl)-isobutyramidine
|
|
6 | 205.890 |
| 48-995-5 |
labd-7,13-(E)-dien-15-ol
|
|
6 | 268.210 |
| 49-026-9 |
Benzoic acid, 2-(methylthio)-, tert.-butyl ester
|
|
6 | 179.970 |
| 49-092-6 |
Isonipecotic acid, N-(3-methylbutyryl)-, pentadecyl ester
|
|
6 | 385.330 |
| 49-182-6 |
3,3-Dimethyl-2-norbornanone dimethyl ketal
|
124287-82-7 |
6 | 155.870 |
| 49-333-8 |
2-Butanone, 4-phenyl, PFBO # 1
|
|
6 | 223.270 |
| 49-340-0 |
3,4-Difluorobenzoic acid, 2-pentyl ester
|
|
6 | 167.160 |
| 49-650-6 |
2,2 Bis(p-allyloxy phenyl) butane
|
116346-12-4 |
6 | 276.460 |
| 50-079-9 |
Eudesma-3,5-dien-1«beta»-ol
|
|
6 | 183.670 |
| 50-358-9 |
Eremophil-7(11)-en-10-«beta»-ol
|
|
6 | 202.060 |
| 50-792-7 |
2-Trifluoromethylbenzoic acid, 3,4-dichlorophenyl ester
|
|
6 | 197.830 |
| 51-068-0 |
Guaia-1(10),11-dien-15-al
|
|
6 | 193.460 |
| 51-184-1 |
l-Proline, N-(m-toluoyl)-, methyl ester
|
|
6 | 192.490 |
| 51-548-7 |
Isonipecotic acid, N-(2-trifluoromethylbenzoyl)-, tridecyl ester
|
|
6 | 380.970 |
| 51-569-4 |
2,6-Dichlorobenzyl alcohol, 1-methylpropyl ether
|
|
6 | 172.440 |
| 51-697-2 |
.DELTA.7-Lithocholic acid, acetate-methyl ester
|
|
6 | 358.430 |
| 51-754-8 |
1,2-dimethyl-trans-2-pentyl-cyclopropane
|
|
6 | 140.900 |
| 51-827-7 |
Formic acid, (2-(trifluoromethyl)phenyl)methyl ester
|
|
6 | 126.660 |
| 52-278-6 |
3-Cyclopentylpropionic acid, 2,3-dimethylphenyl ester
|
|
6 | 209.120 |
| 52-328-0 |
Methanimidamide, N'-(2-bromophenyl)-N,N-dimethyl-
|
53746-69-3 |
6 | 147.070 |
| 52-475-7 |
2,3-Dichlorobenzyl alcohol, 2-methylbutyl ether
|
|
6 | 186.530 |
| 52-682-7 |
Phosphonic acid, chloromethyl-, p-chlorophenyl ethyl ester
|
|
6 | 176.460 |
| 52-790-7 |
2-Trifluoromethylbenzoic acid, 3,5-dimethylphenyl ester
|
|
6 | 201.530 |
| 52-868-1 |
trans-Cinnamamide, N,N-dinonyl-3-trifluoromethyl-
|
|
6 | 394.180 |
| 52-999-6 |
1,2,8,9-tetrabromo-dibenzo-dioxin
|
|
6 | 203.300 |
| 53-072-3 |
D-Alanine, N-(4-ethylbenzoyl)-, isohexyl ester
|
|
6 | 259.710 |
| 53-395-5 |
Dimethylmalonic acid, 2,5-dichlorophenyl isohexyl ester
|
|
6 | 265.990 |
| 53-453-0 |
Dibenzodioxin, 1,9-dibromo-, 2,6-dichloro-
|
|
6 | 192.780 |
| 53-556-6 |
N'-(1-naphthyl)-N,N-dimethyl-formamidine
|
|
6 | 166.470 |
| 53-718-6 |
2-Cyclopenten-1-one, 3,4-dimethyl-
|
30434-64-1 |
6 | 95.900 |
| 53-723-0 |
1,3-Cyclohexanedimethanol, 2-hydroxy-5-methyl-
|
90677-23-9 |
6 | 144.420 |
| 54-161-3 |
Isonipecotic acid, N-(3-methylbutyryl)-, dodecyl ester
|
|
6 | 343.060 |
| 54-455-7 |
3-Vinyl-1,2-dithiacyclohex-5-ene
|
62488-53-3 |
6 | 108.640 |
| 54-952-5 |
1,3-Benzodioxole, 5-hydroxymethyl-6-nitro-
|
|
6 | 123.990 |
|
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