| SpectraBase Spectrum ID |
KWYZd8rpfoB |
| Name |
1-(4-(1-Hydroxybut-3-enyl)phenyl)ethanone |
| 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/c1-3-4-12(14)11-7-5-10(6-8-11)9(2)13/h3,5-8,12,14H,1,4H2,2H3 |
| InChIKey |
KPQVGZHMWLJYMR-UHFFFAOYSA-N |
| Molecular Weight |
190.242 g/mol |
| SMILES |
C(C)(C=1C=CC(=CC1)C(CC=C)O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.907856 |
