| SpectraBase Spectrum ID |
9yQTdZaKzXv |
| Name |
3-Hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
176.083729624 u |
| Formula |
C11H12O2 |
| InChI |
InChI=1S/C11H12O2/c12-9-6-5-8-3-1-2-4-11(13)10(8)7-9/h5-7,12H,1-4H2 |
| InChIKey |
HLXSWBJLBDPTAV-UHFFFAOYSA-N |
| Molecular Weight |
176.215 g/mol |
| SMILES |
C1(O)=CC=C2C(C(=O)CCCC2)=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.96718 |
![3-Hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one](/api/spectrum/9yQTdZaKzXv/structure.png?h=300&w=458 "3-Hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one")
