![2H-Indeno[5,4-f]quinoline, 4-azaandrostan-3-one deriv.](/api/spectrum/DI6zeXUs1q1/structure.png?h=300&w=458 "2H-Indeno[5,4-f]quinoline, 4-azaandrostan-3-one deriv.")
| SpectraBase Compound ID | 1VnefHnaRTC |
|---|---|
| InChI | InChI=1S/C24H33NO2S/c1-23-15-13-22(26)25-20(23)10-8-17-18-9-11-21(24(18,2)14-12-19(17)23)27-28-16-6-4-3-5-7-16/h3-7,17-21H,8-15H2,1-2H3,(H,25,26)/t17-,18-,19-,20+,21-,23+,24-/m0/s1 |
| InChIKey | FFHAJXVYJSGDSS-WIEXBFLVSA-N |
| Mol Weight | 399.6 g/mol |
| Molecular Formula | C24H33NO2S |
| Exact Mass | 399.2232 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DI6zeXUs1q1 |
|---|---|
| Name | 2H-Indeno[5,4-F]quinoline, 4-azaandrostan-3-one deriv. |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 399.223200479 u |
| Formula | C24H33NO2S |
| InChI | InChI=1S/C24H33NO2S/c1-23-15-13-22(26)25-20(23)10-8-17-18-9-11-21(24(18,2)14-12-19(17)23)27-28-16-6-4-3-5-7-16/h3-7,17-21H,8-15H2,1-2H3,(H,25,26)/t17-,18-,19-,20+,21-,23+,24-/m0/s1 |
| InChIKey | FFHAJXVYJSGDSS-WIEXBFLVSA-N |
| Molecular Weight | 399.593 g/mol |
| SMILES | [C@@]12([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)(OSC=3C=CC=CC3)[H])[H])([H])CC[C@]2(NC(CC1)=O)[H])[H])C |