| SpectraBase Spectrum ID |
BGRfY4CmNPe |
| Name |
1,2-Benzenediol, o-acryloyl-o'-(3-chloropropionyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
254.034586530 u |
| Formula |
C12H11ClO4 |
| InChI |
InChI=1S/C12H11ClO4/c1-2-11(14)16-9-5-3-4-6-10(9)17-12(15)7-8-13/h2-6H,1,7-8H2 |
| InChIKey |
VWDJTVWWCDXEKK-UHFFFAOYSA-N |
| Molecular Weight |
254.669 g/mol |
| SMILES |
C1(=CC=CC=C1OC(=O)CCCl)OC(C=C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.968734 |
