| SpectraBase Spectrum ID |
8FybmT4sMsa |
| Name |
3,5-Dimethoxybenzoic acid |
| CAS Registry Number |
1132-21-4 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
182.057908798 u |
| Formula |
C9H10O4 |
| InChI |
InChI=1S/C9H10O4/c1-12-7-3-6(9(10)11)4-8(5-7)13-2/h3-5H,1-2H3,(H,10,11) |
| InChIKey |
IWPZKOJSYQZABD-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
182.175 g/mol |
| Nominal Mass |
182 u |
| Quality |
993 |
| Retention Index |
1308 |
| SMILES |
OC(C=1C=C(C=C(C1)OC)OC)=O |
| SPLASH |
splash10-001i-4900000000-19274b285917055aa5af |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3,5-dimethoxybenzoic acid |
| Technique |
GC/MS |
| Wiley ID |
DD2024_001005 |
