| SpectraBase Spectrum ID |
3hzSqK8cMK |
| Name |
3-Oxoandrosta-4,16-diene-17-carbonitrilee |
| Alternate Name(s) |
3-Oxoandrosta-4,16-diene-17-carbonitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H25NO |
| InChI |
InChI=1S/C20H25NO/c1-19-9-7-15(22)11-13(19)3-5-16-17-6-4-14(12-21)20(17,2)10-8-18(16)19/h4,11,16-18H,3,5-10H2,1-2H3/t16?,17?,18?,19-,20+/m0/s1 |
| InChIKey |
INNGRRMTIBILRQ-FLFGOLRNSA-N |
| Molecular Weight |
295.426 g/mol |
| SMILES |
[C@@]12(C(=CC(CC2)=O)CCC2C3CC=C([C@]3(CCC12)C)C#N)C |
| SPLASH |
splash10-05bf-9450000000-e4bf1658579f59377ff2 |
| Source of Spectrum |
G-62-1101-6 |
| Wiley ID |
749226 |
