| SpectraBase Spectrum ID |
CfxSl7iIEhv |
| Name |
(4ar,5S)-1-Hydroxy-4A,5-dimethyl-3-(propan-2-ylidene)-4,4A,5,6,7,8-hexahydronaphthalen-2(3H)-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
234.161979946 u |
| Formula |
C15H22O2 |
| InChI |
InChI=1S/C15H22O2/c1-9(2)11-8-15(4)10(3)6-5-7-12(15)14(17)13(11)16/h10,17H,5-8H2,1-4H3 |
| InChIKey |
PIGIXBXGOOKXOZ-UHFFFAOYSA-N |
| Molecular Weight |
234.339 g/mol |
| SMILES |
C=1(C(C(CC2(C1CCCC2C)C)=C(C)C)=O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.89571 |
