| SpectraBase Spectrum ID |
Clj2dfyTF66 |
| Name |
Acetonitrile, (1,1-dimethylethoxy)[(5.alpha.)-17-oxoandrostan-3-ylidene]- |
| Alternate Name(s) |
Androstane, acetonitrile deriv.
(2Z)-tert-butoxy[(5alpha)-17-oxoandrostan-3-ylidene]ethanenitrile
3-(cyano-tert-butoxymethylene)-5.alpha.-androstane-17-one |
| CAS Registry Number |
62115-02-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H37NO2 |
| InChI |
InChI=1S/C25H37NO2/c1-23(2,3)28-21(15-26)16-10-12-24(4)17(14-16)6-7-18-19-8-9-22(27)25(19,5)13-11-20(18)24/h17-20H,6-14H2,1-5H3/b21-16-/t17-,18-,19-,20-,24-,25-/m0/s1 |
| InChIKey |
IIOOMJYNXUJXBF-ZSTBWXAISA-N |
| Molecular Weight |
383.576 g/mol |
| SMILES |
[C@@]12([C@@]3([C@@]([C@@]4(CCC([C@]4(CC3)C)=O)[H])([H])CC[C@]2(C\C(CC1)=C\(C#N)OC(C)(C)C)[H])[H])C |
| SPLASH |
splash10-0a89-4009000000-8ca9f63a7dce9a2417de |
| Source of Spectrum |
C-99-185-0 |
| Wiley ID |
1361184 |
![Acetonitrile, (1,1-dimethylethoxy)[(5.alpha.)-17-oxoandrostan-3-ylidene]-](/api/spectrum/Clj2dfyTF66/structure.png?h=300&w=458 "Acetonitrile, (1,1-dimethylethoxy)[(5.alpha.)-17-oxoandrostan-3-ylidene]-")
