| SpectraBase Spectrum ID |
HvPGaj7m5Jc |
| Name |
5-CYANO-3,19-DIOXOANDROSTAN-17-YL ACETATE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
371.209658414 u |
| Formula |
C22H29NO4 |
| InChI |
InChI=1S/C22H29NO4/c1-14(25)27-19-4-3-17-16-6-9-21(12-23)11-15(26)5-10-22(21,13-24)18(16)7-8-20(17,19)2/h13,16-19H,3-11H2,1-2H3/t16?,17?,18?,19?,20-,21?,22-/m0/s1 |
| InChIKey |
TWHOHNWLJKZPBE-SHYNRMMCSA-N |
| Molecular Weight |
371.477 g/mol |
| Nominal Mass |
371 u |
| Number of Peaks |
300 |
| SMILES |
C(C)(=O)OC1CCC2C3CCC4(CC(CC[C@@]4(C3CC[C@]12C)C=O)=O)C#N |
| SPLASH |
splash10-0006-7931000000-8f42e8ef0de272a6667f |
| Source File Reference |
LMCM-65607-736W |
| Source of Spectrum |
Prof. J. Seibl; ETH Zurich, Switzerland |
| Synonyms |
(2S,15S)-7-cyano-2-formyl-15-methyl-5-oxotetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-14-yl acetate
ACETIC ACID 5-CYANO-10-FORMYL-13-METHYL-3-OXO-HEXADECAHYDRO-CYCLOPENTA[A]PHENANTHREN-17-YL ESTER |
| Wiley ID |
8_13309 |
