| SpectraBase Compound ID | 4VcWcaBi12N |
|---|---|
| InChI | InChI=1S/C21H32N2O3/c1-20-10-9-14(22-25-3)11-13(20)5-6-15-16-7-8-18(23-26-4)21(16,2)19(24)12-17(15)20/h11,15-17,19,24H,5-10,12H2,1-4H3/b22-14+,23-18+ |
| InChIKey | SMKCNNLJYKZAFZ-BSEQPRGQSA-N |
| Mol Weight | 360.5 g/mol |
| Molecular Formula | C21H32N2O3 |
| Exact Mass | 360.241293 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DnPkjHxojRi |
|---|---|
| Name | Androst-4-ene-3,17-dione, 12-hydroxy-, bis(O-methyloxime), (12.beta.)- |
| CAS Registry Number | 69688-31-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H32N2O3 |
| InChI | InChI=1S/C21H32N2O3/c1-20-10-9-14(22-25-3)11-13(20)5-6-15-16-7-8-18(23-26-4)21(16,2)19(24)12-17(15)20/h11,15-17,19,24H,5-10,12H2,1-4H3/b22-14+,23-18+ |
| InChIKey | SMKCNNLJYKZAFZ-BSEQPRGQSA-N |
| Molecular Weight | 360.498 g/mol |
| SMILES | OC1CC2C3(CC\C(=N/OC)C=C3CCC2C2C1(C)\C(CC2)=N\OC)C |
| SPLASH | splash10-03fr-0935000000-743de99c0015923d5320 |
| Source of Spectrum | W5-31528-0-0 |
| Synonyms | 12-Hydroxyandrost-4-ene-3,17-dione bis(O-methyloxime) (3E,17E)-10,13-dimethyl-3,17-bis(methyloximino)-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-12-ol (3E,17E)-3,17-bis(methoxyimino)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-12-ol |
| Wiley ID | 1348477 |