| SpectraBase Spectrum ID |
I665htRnXi2 |
| Name |
4-Pentylbenzoin; ethanone, 2-hydroxy-2-(4-pentylphenyl)-1-phenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
282.161979946 u |
| Formula |
C19H22O2 |
| InChI |
InChI=1S/C19H22O2/c1-2-3-5-8-15-11-13-17(14-12-15)19(21)18(20)16-9-6-4-7-10-16/h4,6-7,9-14,19,21H,2-3,5,8H2,1H3 |
| InChIKey |
RIZROTFCRIUSQK-UHFFFAOYSA-N |
| Molecular Weight |
282.383 g/mol |
| SMILES |
OC(C(C1=CC=CC=C1)=O)C1=CC=C(C=C1)CCCCC |
| Spectrum/Structure Validation Score (Raman) |
0.904169 |
