| SpectraBase Spectrum ID |
4dUsBWCUnQT |
| Name |
1,2-Benzenediol, o-dichloroacetyl-o'-(3-methylbut-2-enoyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
302.011264262 u |
| Formula |
C13H12Cl2O4 |
| InChI |
InChI=1S/C13H12Cl2O4/c1-8(2)7-11(16)18-9-5-3-4-6-10(9)19-13(17)12(14)15/h3-7,12H,1-2H3 |
| InChIKey |
GCWJYYIKZSMIDV-UHFFFAOYSA-N |
| SMILES |
C1(=CC=CC=C1OC(=O)C=C(C)C)OC(=O)C(Cl)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.873729 |
