| SpectraBase Spectrum ID |
8GkREBJYtcm |
| Name |
Salicylic acid-M (Glycin adduct) ME |
| Classification |
Pharmaceutical drug metabolite |
| Comments |
Spectrum verified by crosschecking against external libraries (three 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 |
223.084457899 u |
| Formula |
C11H13NO4 |
| InChI |
InChI=1S/C11H13NO4/c1-15-9-6-4-3-5-8(9)11(14)12-7-10(13)16-2/h3-6H,7H2,1-2H3,(H,12,14) |
| InChIKey |
DMFZPUCQOXSNME-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
223.228 g/mol |
| Nominal Mass |
223 u |
| Quality |
860 |
| Retention Index |
1706 |
| SMILES |
C1(C(NCC(OC)=O)=O)=C(C=CC=C1)OC |
| SPLASH |
splash10-000i-7900000000-762827ab8886953b6cec |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2-Hydroxyhippuricacid,methyl ether,methyl ester
o-Methoxyhippuric acid methyl ester
Methyl-2-[(2-methoxybenzoyl)amino]acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_001993 |
