| SpectraBase Spectrum ID |
JLIUI5qTwGq |
| Name |
5.alpha.-Androstano-18-nitrile |
| Appearance |
Colorless crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
271.229999938 u |
| Formula |
C19H29N |
| InChI |
InChI=1S/C19H29N/c1-18-10-3-2-5-14(18)7-8-15-16(18)9-12-19(13-20)11-4-6-17(15)19/h14-17H,2-12H2,1H3/t14-,15-,16+,17+,18+,19+/m1/s1 |
| InChIKey |
XZXIGFVOPNUSOD-SVMUCYCZSA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201502148 |
| Optical Rotation |
[a]D20 = +8.3 (CH2Cl2, 1 g/L) |
| Quality |
392 |
| Reported Formula |
C19H29N |
| SMILES |
C1C[C@]2([C@](CC1)(CC[C@@]1([C@@]2(CC[C@]2([C@]1(CCC2)[H])C#N)[H])[H])[H])C |
| SPLASH |
splash10-052b-9100000000-9ec8e48d594dccf19f1c |
| Source of Spectrum |
QE-21-12507-16 (DOI: 10.1002/chem.201502148) |
| Wiley ID |
1909167 |
