| SpectraBase Compound ID | KZQfNqeeKVz |
|---|---|
| InChI | InChI=1S/C27H43N3O2/c1-5-6-17-28-25(32)30(18-7-8-18)23-12-10-20-19-9-11-22-26(2,16-14-24(31)29(22)4)21(19)13-15-27(20,23)3/h14,16,18-23H,5-13,15,17H2,1-4H3,(H,28,32)/t19?,20?,21?,22?,23-,26+,27-/m0/s1 |
| InChIKey | HCSHXQDODZWSFG-YMULESKKSA-N |
| Mol Weight | 441.7 g/mol |
| Molecular Formula | C27H43N3O2 |
| Exact Mass | 441.335528 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Ja1nJsmDwsY |
|---|---|
| Name | 17.beta.-(Ureylene-N-cyclopropyl-N'-butyl)-4-methyl-4-aza-5.alpha.-androst-1-en-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H43N3O2 |
| InChI | InChI=1S/C27H43N3O2/c1-5-6-17-28-25(32)30(18-7-8-18)23-12-10-20-19-9-11-22-26(2,16-14-24(31)29(22)4)21(19)13-15-27(20,23)3/h14,16,18-23H,5-13,15,17H2,1-4H3,(H,28,32)/t19?,20?,21?,22?,23-,26+,27-/m0/s1 |
| InChIKey | HCSHXQDODZWSFG-YMULESKKSA-N |
| Molecular Weight | 441.660 g/mol |
| SMILES | N(C(N([C@@]1([C@]2(CCC3[C@@]4(C(N(C(=O)C=C4)C)CCC3C2CC1)C)C)[H])C1CC1)=O)CCCC |
| SPLASH | splash10-01tc-0009700000-1654d78f4e7abfde132b |
| Source of Spectrum | G2-5-308-3'd |
| Wiley ID | 1705351 |