SpectraBase Spectrum ID |
SUQcZUt4u4 |
Name |
(Z)-4-Phenyl-2-o-tolylbut-2-en-1-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
238.135765199 u |
Formula |
C17H18O |
InChI |
InChI=1S/C17H18O/c1-14-7-5-6-10-17(14)16(13-18)12-11-15-8-3-2-4-9-15/h2-10,12,18H,11,13H2,1H3/b16-12+ |
InChIKey |
LERQCLVFMZFYGK-FOWTUZBSSA-N |
Molecular Weight |
238.330 g/mol |
SMILES |
C=1C=C(C(\C(CO)=C\CC2=CC=CC=C2)=CC1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.831086 |