| SpectraBase Spectrum ID |
8bJwEpVER0W |
| Name |
1,5-Dimethyl-1,2,3,5,6,7-hexahydro-S-indacene-4,8-diol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
218.130679818 u |
| Formula |
C14H18O2 |
| InChI |
InChI=1S/C14H18O2/c1-7-3-5-9-11(7)13(15)10-6-4-8(2)12(10)14(9)16/h7-8,15-16H,3-6H2,1-2H3 |
| InChIKey |
FHQULQRMJSBEDE-UHFFFAOYSA-N |
| Molecular Weight |
218.296 g/mol |
| SMILES |
C1(CCC=2C(=C3C(CCC3=C(C12)O)C)O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.948905 |
