| SpectraBase Spectrum ID |
4axRG1i24JP |
| Name |
3-Hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one, o-methyl |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
190.099379689 u |
| Formula |
C12H14O2 |
| InChI |
InChI=1S/C12H14O2/c1-14-10-7-6-9-4-2-3-5-12(13)11(9)8-10/h6-8H,2-5H2,1H3 |
| InChIKey |
JXRMNNQXGGHSQM-UHFFFAOYSA-N |
| Molecular Weight |
190.242 g/mol |
| SMILES |
COC=1C=C2C(=O)CCCCC2=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.947771 |
![3-Hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one, o-methyl](/api/spectrum/4axRG1i24JP/structure.png?h=300&w=458 "3-Hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one, o-methyl")
