SpectraBase Spectrum ID |
IBMFTQQ2KgH |
Name |
(E)-3-[3-[(E)-3-Hydroxyprop-1-enyl]phenyl]-2-propen-1-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
190.099379689 u |
Formula |
C12H14O2 |
InChI |
InChI=1S/C12H14O2/c13-8-2-6-11-4-1-5-12(10-11)7-3-9-14/h1-7,10,13-14H,8-9H2/b6-2+,7-3+ |
InChIKey |
ZURUGFXULGVUMJ-YPCIICBESA-N |
Molecular Weight |
190.242 g/mol |
SMILES |
C(\C=C\C1=CC(\C=C\CO)=CC=C1)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.930799 |