| SpectraBase Spectrum ID |
JEzwcM6FE8m |
| Name |
3,5-Dimethoxybenzoicacid methyl ester |
| CAS Registry Number |
2150-37-0 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
196.073558862 u |
| Formula |
C10H12O4 |
| InChI |
InChI=1S/C10H12O4/c1-12-8-4-7(10(11)14-3)5-9(6-8)13-2/h4-6H,1-3H3 |
| InChIKey |
YXUIOVUOFQKWDM-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
196.202 g/mol |
| Nominal Mass |
196 u |
| Quality |
989 |
| Retention Index |
1408 |
| SMILES |
C=1(C(OC)=O)C=C(C=C(C1)OC)OC |
| SPLASH |
splash10-00kk-3900000000-0c91f57c5034618157d4 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
methyl 3,5-dimethoxybenzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_001006 |
