| SpectraBase Spectrum ID |
YJt5lAw3gR |
| Name |
2-(1-Hydroxy-2-phenyl-ethyl)cyclohex-2-en-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
216.115029753 u |
| Formula |
C14H16O2 |
| InChI |
InChI=1S/C14H16O2/c15-13-9-5-4-8-12(13)14(16)10-11-6-2-1-3-7-11/h1-3,6-8,14,16H,4-5,9-10H2 |
| InChIKey |
KLNDSAALGCDWNP-UHFFFAOYSA-N |
| Molecular Weight |
216.280 g/mol |
| SMILES |
C=1(C(CC2=CC=CC=C2)O)C(=O)CCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.930852 |
