| ID | Name | CAS | Data |
McVol (ml/mol) |
| 44-117-3 |
1,2-Benzisothiazole
|
272-16-2 |
4 | 96.900 |
| 44-183-0 |
Penbutolol dihydroxy, acetylated
|
|
4 | 382.320 |
| 45-003-8 |
(E)-«alpha»-santalol
|
|
4 | 191.200 |
| 45-096-6 |
5-Bromofuroic acid
|
|
4 | 92.660 |
| 45-268-5 |
Cyclohexanone, oxime, acetate
|
|
4 | 125.840 |
| 45-433-1 |
6«beta»-Hydroxyhyoscyamine
|
52646-91-0 |
4 | 234.070 |
| 45-622-1 |
.beta.-Naginatene epoxide
|
|
4 | 133.180 |
| 46-465-5 |
N-benzylpiperazine, TFA
|
|
4 | 186.250 |
| 46-696-9 |
1,2-Dehydrosesquicineole
|
|
4 | 197.760 |
| 47-605-8 |
2-Propanone, ethylhydrazone
|
7422-99-3 |
4 | 96.970 |
| 47-713-8 |
Adenine, N4-heptafluorobutyryl-
|
|
4 | 162.610 |
| 48-292-5 |
N-propyl-Octahydroindole
|
|
4 | 154.110 |
| 49-266-3 |
Pyridine, 2-(allylamino)-
|
|
4 | 115.480 |
| 49-347-3 |
Scopoletin, O-pentafluoropropionyl-
|
|
4 | 184.710 |
| 50-351-6 |
Phosphinodithioic acid, diphenyl-
|
|
4 | 185.580 |
| 51-448-8 |
Dimethylaminomethylidene-t-butylamine
|
|
4 | 125.150 |
| 52-041-8 |
2-Chlorobenzyl isothiocyanate
|
|
4 | 129.790 |
| 52-482-9 |
13«beta»-hydroxylupanine
|
|
4 | 206.170 |
| 53-126-3 |
Adenosine, 2-azido-
|
59587-07-4 |
4 | 196.700 |
| 53-759-1 |
((CH3)2N)2C=NC2H5
|
|
4 | 135.130 |
| 54-315-2 |
2-Pentanone, methylhydrazone
|
|
4 | 111.060 |
| 55-382-7 |
Uridine, 5-iodo-
|
1024-99-3 |
4 | 184.050 |
| 55-625-7 |
N-Phenylbis(trifluoromethanesulphonimide)
|
|
4 | 176.600 |
| 55-834-5 |
3',5'-Diacetylthymidine
|
6979-97-1 |
4 | 225.950 |
| 57-581-4 |
Thiazolidine, 2-isobutyl-
|
696-70-8 |
4 | 124.960 |
| 57-598-6 |
2-Propanone, dimethylhydrazone
|
13483-31-3 |
4 | 96.970 |
| 57-874-9 |
Adenine, 2-(methylthio)-
|
|
4 | 122.730 |
| 58-274-4 |
Adenine, 2-chloro-
|
1839-18-5 |
4 | 104.530 |
| 58-524-6 |
Benzene, pentachloro(trichloroethenyl)-
|
|
4 | 193.440 |
| 58-595-8 |
6-MERCAPTOPURINE RIBOSIDE
|
|
4 | 181.730 |
| 59-131-1 |
Indenone ethylene ketal
|
6710-43-6 |
4 | 127.810 |
| 60-469-5 |
3«beta»-Tigloyloxylupanine
|
|
4 | 273.890 |
| 61-642-1 |
11,12-Dihydrosparteine
|
|
4 | 209.590 |
| 61-916-7 |
4.beta.-Tigloyloxylupanine
|
|
4 | 273.890 |
| 62-268-6 |
Pentanoic acid, morpholide
|
|
4 | 144.230 |
| 62-589-0 |
trans-Carvyl propionate
|
145032-51-5 |
4 | 182.010 |
| 64-382-7 |
Decamethyl-[5]pericyclyne
|
88057-40-3 |
4 | 309.250 |
| 64-764-3 |
3«beta»-Hydroxylupanine
|
|
4 | 206.170 |
| 65-531-0 |
Phosphine, tris(trifluoromethyl)-
|
432-04-2 |
4 | 89.520 |
| 66-425-7 |
3«beta»-Propanyloxylupanine
|
|
4 | 250.010 |
| 66-477-0 |
(3S)-(-)-3-Acetamidopyrrolidine
|
79286-74-1 |
4 | 106.070 |
| 66-895-6 |
Scopoletin, O-trifluoroacetyl-
|
|
4 | 167.080 |
| 68-358-0 |
Thiazolidine, N-isoBOC
|
|
4 | 146.490 |
| 68-444-4 |
Rhodanine, 5-salicylidene-
|
34709-44-9 |
4 | 158.660 |
| 69-604-5 |
Isatin, 3-thiosemicarbazone
|
487-16-1 |
4 | 152.290 |
| 70-134-5 |
Cytidine, N-acetyl-
|
3768-18-1 |
4 | 192.090 |
| 70-953-6 |
Carvyl propionate, cis-
|
145032-50-4 |
4 | 182.010 |
| 71-060-6 |
Erythromycin, ethyl carbonate
|
|
4 | 627.010 |
| 71-743-8 |
trans-Sesquisabinene hydrate
|
|
4 | 202.060 |
| 71-870-7 |
cis-sesquisabinene hydrate
|
|
4 | 202.060 |
| 72-753-6 |
4',5'-Diiodofluorescein
|
|
4 | 287.210 |
| 73-789-6 |
Clobenzorex, N-trifluoroacetyl
|
|
4 | 246.060 |
| 74-373-6 |
3',4'-Dichloropelargoanilide
|
|
4 | 234.480 |
| 75-028-8 |
cis-«beta»-sesquiphellandrol
|
|
4 | 204.320 |
| 75-444-6 |
Phosphinothioic acid, diphenyl-
|
14278-72-9 |
4 | 175.100 |
| 77-468-8 |
DOPA, HFIP-PFP
|
|
4 | 354.030 |
| 77-799-1 |
1-Isopropyl-azetidine
|
|
4 | 94.520 |
| 78-699-1 |
D-CAMPHORIC ANHYDRIDE
|
|
4 | 139.050 |
| 78-713-4 |
6-n-Amylmercaptopurine
|
5443-89-0 |
4 | 169.110 |
| 78-834-0 |
Rhodanine, 5-benzylidene
|
|
4 | 152.790 |
| 79-590-0 |
N-ethyl-dihydroindole
|
|
4 | 127.120 |
| 79-684-6 |
6,7-Epoxymyrcene
|
|
4 | 138.170 |
| 79-691-8 |
2-carene epoxide
|
|
4 | 125.050 |
| 79-816-9 |
Pentakis(methylthio)benzene
|
|
4 | 223.840 |
| 79-862-8 |
4-Hydroxycoumarin, trifluoroacetate
|
|
4 | 147.120 |
| 80-749-2 |
Formamide, N-isopropyl
|
|
4 | 78.770 |
| 80-950-8 |
Thiazolidine, 2-isopropyl-
|
|
4 | 110.870 |
| 81-163-1 |
1,2-Dimethylpyridone
|
|
4 | 101.580 |
| 81-405-2 |
Methacrylamide, N-butyl-
|
|
4 | 130.830 |
| 82-578-0 |
Ethanol, 2-(dicyclohexylamino)-,
|
|
4 | 202.250 |
| 83-198-1 |
(5-Nonyl)pyrazine
|
|
4 | 190.230 |
| 83-227-8 |
6-(Octylthio)purine
|
6974-89-6 |
4 | 211.380 |
| 83-365-5 |
2-Phenoxynicotinic acid
|
|
4 | 155.710 |
| 83-481-6 |
Adenosine, 2-methoxy-
|
|
4 | 195.320 |
| 83-511-2 |
N,N-DIETHYLNIPEOTAMIDE
|
|
4 | 162.430 |
| 84-388-9 |
Nalcamine g-13
|
|
4 | 327.210 |
| 84-702-9 |
Thioridazine M (oxo-)
|
|
4 | 291.740 |
| 85-443-6 |
Rhodanine, 5-cinnamylidene-
|
|
4 | 176.670 |
| 85-558-9 |
Phosphorous triamide, hexaethyl-
|
2283-11-6 |
4 | 230.340 |
| 85-729-9 |
Cyclopentanecarboxylic acid, morpholide
|
|
4 | 147.460 |
| 85-736-1 |
[2H6]Isopentenyladenine, permethylated
|
|
4 | 186.620 |
| 87-978-1 |
Oxazole, 5-methyl
|
|
4 | 63.610 |
| 88-195-9 |
PHOSPHINE SULFIDE, TRIMETHYL-
|
|
4 | 89.940 |
| 88-217-4 |
2-Chloroethyl isothiocyanate
|
|
4 | 83.100 |
| 90-996-7 |
Chromone-3-carbonitrile
|
50743-17-4 |
4 | 121.660 |
| 91-659-0 |
2,2-Dichlorocyclopropylacetonitrile
|
5365-25-3 |
4 | 96.310 |
| 91-852-5 |
9,9-Fluorenedipropionitrile
|
|
4 | 222.950 |
| 91-887-7 |
Hygroline A/B
|
|
4 | 128.570 |
| 91-903-8 |
Hygroline B/A
|
|
4 | 128.570 |
| 92-626-5 |
Acetamide, N-pentyl-
|
|
4 | 121.040 |
| 93-038-7 |
Pentanamide, N-cyclohexyl
|
|
4 | 166.540 |
| 93-318-6 |
Cyclohexanecarboxylic acid, morpholide
|
|
4 | 161.550 |
| 93-741-6 |
«alpha»-Cyclogeraniol acetate
|
|
4 | 172.220 |
| 93-962-1 |
4-Hydroxycoumarin, pentafluoropropionate
|
|
4 | 164.750 |
| 94-430-0 |
2-Benzofuranylethylene glycol
|
|
4 | 130.450 |
| 94-475-1 |
cyclopropanecarboxamide, N-phenyl
|
|
4 | 128.690 |
| 96-241-8 |
3-Quinuclidinyl benzilate
|
|
4 | 260.800 |
| 96-632-4 |
Acetic acid, sulfonyldi-
|
123-45-5 |
4 | 110.190 |
| 96-660-3 |
3(2H)-Pyridazinone
|
504-30-3 |
4 | 69.290 |
| 96-699-1 |
2-Mercaptoethyl ether
|
|
4 | 105.790 |
|
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