| SpectraBase Spectrum ID |
35F8a2DyEUz |
| Name |
Phenethyl alcohol, .alpha.-benzyl-p-chloro-.alpha.-phenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.112442931 u |
| Formula |
C21H19ClO |
| InChI |
InChI=1S/C21H19ClO/c22-20-13-11-18(12-14-20)16-21(23,19-9-5-2-6-10-19)15-17-7-3-1-4-8-17/h1-14,23H,15-16H2 |
| InChIKey |
BKOSNKMHNIROQK-UHFFFAOYSA-N |
| Molecular Weight |
322.835 g/mol |
| SMILES |
C(C(O)(CC1=CC=CC=C1)C1=CC=CC=C1)C1=CC=C(Cl)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.901792 |
