| SpectraBase Compound ID | LBFJPmwx5hC |
|---|---|
| InChI | InChI=1S/C19H30O/c1-19-11-3-2-4-14(19)6-8-17-16-9-7-15(20)12-13(16)5-10-18(17)19/h13-14,16-18H,2-12H2,1H3/t13?,14?,16?,17?,18?,19-/m0/s1 |
| InChIKey | PCILNTBZABLTDZ-RUMSHHPPSA-N |
| Mol Weight | 274.45 g/mol |
| Molecular Formula | C19H30O |
| Exact Mass | 274.229666 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3RXUZtFGUHV |
|---|---|
| Name | D-Homo-androstan-17-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.229665585 u |
| Formula | C19H30O |
| InChI | InChI=1S/C19H30O/c1-19-11-3-2-4-14(19)6-8-17-16-9-7-15(20)12-13(16)5-10-18(17)19/h13-14,16-18H,2-12H2,1H3/t13?,14?,16?,17?,18?,19-/m0/s1 |
| InChIKey | PCILNTBZABLTDZ-RUMSHHPPSA-N |
| SMILES | C12[C@@]3(C(CCCC3)CCC1C1C(CC(CC1)=O)CC2)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.824206 |