| SpectraBase Compound ID | DQmUAQem5ST |
|---|---|
| InChI | InChI=1S/C11H8Cl2O4/c1-2-9(14)16-7-4-3-5-8(6-7)17-11(15)10(12)13/h2-6,10H,1H2 |
| InChIKey | WYVGABTXIRVNHX-UHFFFAOYSA-N |
| Mol Weight | 275.09 g/mol |
| Molecular Formula | C11H8Cl2O4 |
| Exact Mass | 273.979964 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ELbnQaN8Jcf |
|---|---|
| Name | 1,3-Benzenediol, o-acryloyl-o'-dichloroacetyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.979964134 u |
| Formula | C11H8Cl2O4 |
| InChI | InChI=1S/C11H8Cl2O4/c1-2-9(14)16-7-4-3-5-8(6-7)17-11(15)10(12)13/h2-6,10H,1H2 |
| InChIKey | WYVGABTXIRVNHX-UHFFFAOYSA-N |
| SMILES | C1(=CC(=CC=C1)OC(C(Cl)Cl)=O)OC(C=C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.816942 |