SpectraBase Spectrum ID |
KQf6ApvDhcR |
Name |
alpha-(3-Ethylbenzoyl)-4-octyl-benzyl alcohol; ethanone, 1-(3-ethylphenyl)-2-hydroxy-2-(4-octylphenyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
352.240230268 u |
Formula |
C24H32O2 |
InChI |
InChI=1S/C24H32O2/c1-3-5-6-7-8-9-11-20-14-16-21(17-15-20)23(25)24(26)22-13-10-12-19(4-2)18-22/h10,12-18,23,25H,3-9,11H2,1-2H3 |
InChIKey |
KMQXSTXYJSGOLT-UHFFFAOYSA-N |
Molecular Weight |
352.518 g/mol |
SMILES |
OC(C1=CC=C(C=C1)CCCCCCCC)C(C1=CC(=CC=C1)CC)=O |
Spectrum/Structure Validation Score (Raman) |
0.957882 |