| SpectraBase Compound ID | DjeLxCW1FFZ |
|---|---|
| InChI | InChI=1S/C19H32O/c1-12-8-10-18(2)14(12)5-4-13-15-6-7-17(20)19(15,3)11-9-16(13)18/h12-17,20H,4-11H2,1-3H3/t12-,13?,14+,15?,16?,17-,18-,19-/m0/s1 |
| InChIKey | HHKWSZBYZDGOLI-YNSKCVQZSA-N |
| Mol Weight | 276.5 g/mol |
| Molecular Formula | C19H32O |
| Exact Mass | 276.245316 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 5mRu8D8YTyh |
|---|---|
| Name | 17.beta.-Hydroxy-3-methyl-A-nor-5.beta.-androstane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.245315649 u |
| Formula | C19H32O |
| InChI | InChI=1S/C19H32O/c1-12-8-10-18(2)14(12)5-4-13-15-6-7-17(20)19(15,3)11-9-16(13)18/h12-17,20H,4-11H2,1-3H3/t12-,13?,14+,15?,16?,17-,18-,19-/m0/s1 |
| InChIKey | HHKWSZBYZDGOLI-YNSKCVQZSA-N |
| Molecular Weight | 276.464 g/mol |
| SMILES | [C@]12(C3C(C4[C@]([C@@](O)(CC4)[H])(C)CC3)CC[C@@]1([C@@](C)(CC2)[H])[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.892741 |