| SpectraBase Spectrum ID |
93xZRgRXwA7 |
| Name |
Methyl 6-dichloromethyl-2-hydroxy-3-methylbenzoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
248.000699579 u |
| Formula |
C10H10Cl2O3 |
| InChI |
InChI=1S/C10H10Cl2O3/c1-5-3-4-6(9(11)12)7(8(5)13)10(14)15-2/h3-4,9,13H,1-2H3 |
| InChIKey |
RJIIZPAMECUKCX-UHFFFAOYSA-N |
| Molecular Weight |
249.093 g/mol |
| SMILES |
C1(=C(C=CC(=C1O)C)C(Cl)Cl)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.85242 |
