SpectraBase Spectrum ID |
AEpaldi1t38 |
Name |
17-Methylene-5.alpha.-androstano-18-nitrile |
Appearance |
Colorless crystals |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
283.229999938 u |
Formula |
C20H29N |
InChI |
InChI=1S/C20H29N/c1-14-6-9-18-16-8-7-15-5-3-4-11-19(15,2)17(16)10-12-20(14,18)13-21/h15-18H,1,3-12H2,2H3/t15-,16-,17+,18+,19+,20+/m1/s1 |
InChIKey |
UCXBYAPFOSGBLD-MILMJNAHSA-N |
Instrument Name |
Finnigan MAT 95 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.201502148 |
Optical Rotation |
[a]D20 = -58 (CH2Cl2, 1 g/L) |
Quality |
300 |
Reported Formula |
C20H29N |
SMILES |
C1C[C@]2([C@](CC1)(CC[C@@]1([C@@]2(CC[C@]2([C@]1(CCC2=C)[H])C#N)[H])[H])[H])C |
SPLASH |
splash10-03di-9500000000-18e064e6a8c7ffd96cf0 |
Source of Spectrum |
QE-21-12506-12 (DOI: 10.1002/chem.201502148) |
Wiley ID |
1909165 |