| SpectraBase Spectrum ID |
8Rl7q254Rqv |
| Name |
(6as,9as,9br)-9A-Hydroxy-2,3,3A,6,6A,7,8,9,9A,9B-decahydro-1-oxa-1H-phenalene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
194.130679818 u |
| Formula |
C12H18O2 |
| InChI |
InChI=1S/C12H18O2/c13-12-7-2-5-9-3-1-4-10(11(9)12)6-8-14-12/h1,4,9-11,13H,2-3,5-8H2/t9-,10?,11-,12+/m1/s1 |
| InChIKey |
NVJMAFZUCUJWQH-WAAKLRNESA-N |
| Molecular Weight |
194.274 g/mol |
| SMILES |
[C@]12([C@]3(C(C=CC[C@]3([H])CCC1)CCO2)[H])O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.934782 |
