| SpectraBase Spectrum ID |
IQjJPM6axDF |
| Name |
Androsta-4,8(14)-diene-3,17-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
284.177630011 u |
| Formula |
C19H24O2 |
| InChI |
InChI=1S/C19H24O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,16H,3-10H2,1-2H3/t16-,18-,19-/m0/s1 |
| InChIKey |
SGPDPQDGYFWQGO-WDSOQIARSA-N |
| SMILES |
C1(=O)[C@@]2(C(=C3[C@]([C@]4(CCC(C=C4CC3)=O)C)([H])CC2)CC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.897836 |
