| SpectraBase Compound ID | BPUzLhHwRfG |
|---|---|
| InChI | InChI=1S/C22H31NO2/c1-13(20(23)25)17-6-7-18-16-5-4-14-12-15(24)8-10-21(14,2)19(16)9-11-22(17,18)3/h8,10,12-13,16-19H,4-7,9,11H2,1-3H3,(H2,23,25)/t13?,16-,17+,18-,19-,21-,22+/m0/s1 |
| InChIKey | WIKMMMPPONXZIX-VJFOQZSSSA-N |
| Mol Weight | 341.5 g/mol |
| Molecular Formula | C22H31NO2 |
| Exact Mass | 341.235479 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | KtpbHSR7d8Q |
|---|---|
| Name | 3-Oxopregna-1,4-diene-20-carbamide |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H31NO2 |
| InChI | InChI=1S/C22H31NO2/c1-13(20(23)25)17-6-7-18-16-5-4-14-12-15(24)8-10-21(14,2)19(16)9-11-22(17,18)3/h8,10,12-13,16-19H,4-7,9,11H2,1-3H3,(H2,23,25)/t13?,16-,17+,18-,19-,21-,22+/m0/s1 |
| InChIKey | WIKMMMPPONXZIX-VJFOQZSSSA-N |
| Molecular Weight | 341.495 g/mol |
| SMILES | NC(C([C@@]1([C@@]2([C@]([C@@]3(CCC=4[C@@]([C@]3(CC2)[H])(C=CC(=O)C4)C)[H])(CC1)[H])C)[H])C)=O |
| SPLASH | splash10-00di-0902000000-0fa01b15afe1844ee176 |
| Source of Spectrum | U-1994-1031-11 |
| Synonyms | 2-[(1S,2R,10S,11S,14R,15S)-2,15-dimethyl-5-oxotetracyclo[8.7.0.0(2,7).0(11,15)]heptadeca-3,6-dien-14-yl]propanamide 2-[(8S,9S,10R,13S,14S,17R)-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]propanamide 2-[(8S,9S,10R,13S,14S,17R)-10,13-dimethyl-3-oxidanylidene-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]propanamide |
| Wiley ID | 766163 |