| SpectraBase Compound ID | B1ECnZige1p |
|---|---|
| InChI | InChI=1S/C21H38N2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h13-19H,4-12,22-23H2,1-3H3 |
| InChIKey | OCWHBSAXYVHWBP-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 | LpxiO969hR8 |
|---|---|
| Name | Pregnane-3,20-diamine, (3.beta.,5.alpha.,20S)- |
| Alternate Name(s) | Pregnane-3,20-diamine 1-(3-amino-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)ethylamine 17-(1-aminoethyl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-amine 17-(1-azanylethyl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-amine 5,6-Dihydroirehidamine A 5.alpha.-Pregnane-3.beta.,20.alpha.-diamine Dihydroirehdiamine A |
| CAS Registry Number | 7050-25-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H38N2 |
| InChI | InChI=1S/C21H38N2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h13-19H,4-12,22-23H2,1-3H3 |
| InChIKey | OCWHBSAXYVHWBP-UHFFFAOYSA-N |
| Molecular Weight | 318.549 g/mol |
| SMILES | NC(C1C2(C(C3C(C4(C(CC(CC4)N)CC3)C)CC2)CC1)C)C |
| SPLASH | splash10-002f-9130000000-8fed6939d4f1047cddb3 |
| Source of Spectrum | PL-1982-0-0 |
| Wiley ID | 1319033 |