SpectraBase Spectrum ID |
JJ5Xv0B6eH2 |
Name |
3-Hydroxybenzoic acid AC |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
180.042258734 u |
Formula |
C9H8O4 |
InChI |
InChI=1S/C9H8O4/c1-6(10)13-8-4-2-3-7(5-8)9(11)12/h2-5H,1H3,(H,11,12) |
InChIKey |
NGMYCWFGNSXLMP-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
180.159 g/mol |
Nominal Mass |
180 u |
Quality |
920 |
Retention Index |
1296 |
SMILES |
OC(C=1C=C(C=CC1)OC(=O)C)=O |
SPLASH |
splash10-00di-2900000000-e8a2d8449719f5876e5a |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
3-(acetyloxy)benzoic acid |
Technique |
GC/MS |
Wiley ID |
DD2024_001656 |