| SpectraBase Compound ID | 6bAnP9uhevn |
|---|---|
| InChI | InChI=1S/C30H46N2O/c1-20(32(4)5)25-13-14-26-24-12-11-22-19-23(31-28(33)21-9-7-6-8-10-21)15-17-29(22,2)27(24)16-18-30(25,26)3/h6-10,20,22-27H,11-19H2,1-5H3,(H,31,33)/t20?,22?,23-,24-,25+,26-,27-,29-,30+/m0/s1 |
| InChIKey | SFKPSOAYNYYOLN-HIYZPXCBSA-N |
| Mol Weight | 450.7 g/mol |
| Molecular Formula | C30H46N2O |
| Exact Mass | 450.361014 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Eta4Fwo01fv |
|---|---|
| Name | 20-(N,N-Dimethylamino)-3.beta.-(benzamido)-pregnane |
| Alternate Name(s) | N-[(3beta)-20-(dimethylamino)pregnan-3-yl]benzamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H46N2O |
| InChI | InChI=1S/C30H46N2O/c1-20(32(4)5)25-13-14-26-24-12-11-22-19-23(31-28(33)21-9-7-6-8-10-21)15-17-29(22,2)27(24)16-18-30(25,26)3/h6-10,20,22-27H,11-19H2,1-5H3,(H,31,33)/t20?,22?,23-,24-,25+,26-,27-,29-,30+/m0/s1 |
| InChIKey | SFKPSOAYNYYOLN-HIYZPXCBSA-N |
| Molecular Weight | 450.711 g/mol |
| SMILES | N([C@]1(CC[C@]2(C(C1)CC[C@]1([C@@]3(CC[C@](C(C)N(C)C)([C@@]3(C)CC[C@]21[H])[H])[H])[H])C)[H])C(c1ccccc1)=O |
| SPLASH | splash10-05fr-7900100000-77a57c9ffea113ad5615 |
| Source of Spectrum | G4-61-205-3 |
| Wiley ID | 1607123 |