| SpectraBase Spectrum ID |
LSKm8Zjbpyv |
| Name |
3,4,6-Trimethoxy-2-methyl-benzoic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
226.084123546 u |
| Formula |
C11H14O5 |
| InChI |
InChI=1S/C11H14O5/c1-6-9(11(12)13)7(14-2)5-8(15-3)10(6)16-4/h5H,1-4H3,(H,12,13) |
| InChIKey |
WIEUXEVVLLQPHA-UHFFFAOYSA-N |
| Molecular Weight |
226.228 g/mol |
| SMILES |
C1(=C(C(OC)=C(C=C1OC)OC)C)C(=O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.898488 |
