| SpectraBase Compound ID | B74vzsnNK2X |
|---|---|
| InChI | InChI=1S/C21H38N2/c1-4-13-6-8-17-16-7-5-14-11-15(22)9-10-20(14,2)19(16)18(23)12-21(13,17)3/h13-19H,4-12,22-23H2,1-3H3 |
| InChIKey | RAUDKDUPSAVVMA-UHFFFAOYSA-N |
| Mol Weight | 318.5 g/mol |
| Molecular Formula | C21H38N2 |
| Exact Mass | 318.303499 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JIksCy2ol1G |
|---|---|
| Name | Pregnane-3,11-diamine |
| Alternate Name(s) | (3-amino-17-ethyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-11-yl)amine 17-ethyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,11-diamine 3.alpha.,11.alpha.-Diamino-pregnane |
| CAS Registry Number | 72560-25-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H38N2 |
| InChI | InChI=1S/C21H38N2/c1-4-13-6-8-17-16-7-5-14-11-15(22)9-10-20(14,2)19(16)18(23)12-21(13,17)3/h13-19H,4-12,22-23H2,1-3H3 |
| InChIKey | RAUDKDUPSAVVMA-UHFFFAOYSA-N |
| Molecular Weight | 318.549 g/mol |
| SMILES | NC1C2C(CCC3C2(CCC(C3)N)C)C2C(C1)(C(CC2)CC)C |
| SPLASH | splash10-07or-7921000000-00f321dea5ed6523ceba |
| Source of Spectrum | O-17-108-2 |
| Wiley ID | 1319038 |