| SpectraBase Spectrum ID |
DCvAZiFfARC |
| Name |
2-.alpha.-Chlorocyanomethyl-3.alpha.-chloro-5.alpha.-cholestane |
| Alternate Name(s) |
2.alpha.-(R)-Chlorocyanomethyl-3.alpha.-chloro-5.alpha.-cholestane
Chloro[(2alpha,3alpha,5alpha)-3-chlorocholestan-2-yl]acetonitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H47Cl2N |
| InChI |
InChI=1S/C29H47Cl2N/c1-18(2)7-6-8-19(3)23-11-12-24-21-10-9-20-15-26(30)22(27(31)17-32)16-29(20,5)25(21)13-14-28(23,24)4/h18-27H,6-16H2,1-5H3/t19-,20+,21+,22-,23-,24+,25+,26+,27?,28-,29+/m1/s1 |
| InChIKey |
IDOVHCXDEPSRAJ-FDLBRKOJSA-N |
| Molecular Weight |
480.608 g/mol |
| SMILES |
[C@@]12([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](CCCC(C)C)(C)[H])[H])[H])([H])CC[C@]2(C[C@](Cl)([C@@](C1)(C(C#N)Cl)[H])[H])[H])[H])C |
| SPLASH |
splash10-00b9-3009400000-d2b28bf1168c3d1a6762 |
| Source of Spectrum |
F-62-1076-18 |
| Wiley ID |
1632022 |
