| SpectraBase Spectrum ID |
HLsnHR7J3b5 |
| Name |
(p-(Allyloxycarbonyl)phenoxy)acetic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
236.068473481 u |
| Formula |
C12H12O5 |
| InChI |
InChI=1S/C12H12O5/c1-2-7-16-12(15)9-3-5-10(6-4-9)17-8-11(13)14/h2-6H,1,7-8H2,(H,13,14) |
| InChIKey |
HWOQAAZPUOOWBF-UHFFFAOYSA-N |
| Molecular Weight |
236.223 g/mol |
| SMILES |
C1=C(C=CC(=C1)OCC(O)=O)C(OCC=C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.821192 |
