SpectraBase Spectrum ID |
Dnnsarrbw6S |
Name |
Homovanillic acid |
CAS Registry Number |
306-08-1 |
Classification |
Pharmaceutical drug, antiparkinsonian |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
182.057908798 u |
Formula |
C9H10O4 |
InChI |
InChI=1S/C9H10O4/c1-13-8-4-6(5-9(11)12)2-3-7(8)10/h2-4,10H,5H2,1H3,(H,11,12) |
InChIKey |
QRMZSPFSDQBLIX-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
182.175 g/mol |
Nominal Mass |
182 u |
Quality |
780 |
Retention Index |
1308 |
SMILES |
OC=1C(=CC(CC(=O)O)=CC1)OC |
SPLASH |
splash10-000i-2900000000-f451151ec32fb4522b5d |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Acetic acid,2-(4-hydroxy-3-methoxyphenyl)
2-(4-Hydroxy-3-methoxyphenyl)acetic acid |
Technique |
GC/MS |
Wiley ID |
DD2024_001621 |