SpectraBase Spectrum ID |
8uK4IrbpjNX |
Name |
4-Benzylphenol acetate; p-cresol, alpha-phenyl-, acetate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
226.099379689 u |
Formula |
C15H14O2 |
InChI |
InChI=1S/C15H14O2/c1-12(16)17-15-9-7-14(8-10-15)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3 |
InChIKey |
GPCKNPVCSNHSQG-UHFFFAOYSA-N |
Molecular Weight |
226.275 g/mol |
SMILES |
C1(=CC=C(C=C1)CC1=CC=CC=C1)OC(C)=O |
Spectrum/Structure Validation Score (Raman) |
0.922632 |