| SpectraBase Spectrum ID |
DTndcUV7eNI |
| Name |
4-Aminobenzoic acid |
| CAS Registry Number |
150-13-0 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
137.047678467 u |
| Formula |
C7H7NO2 |
| InChI |
InChI=1S/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10) |
| InChIKey |
ALYNCZNDIQEVRV-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
137.138 g/mol |
| Nominal Mass |
137 u |
| Quality |
997 |
| Retention Index |
1062 |
| SMILES |
OC(C1=CC=C(C=C1)N)=O |
| SPLASH |
splash10-00dr-6900000000-0cbe1d03307fb8b27c16 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Technique |
GC/MS |
| Wiley ID |
DD2024_018267 |
