| SpectraBase Spectrum ID |
1XU8VDY6t8X |
| Name |
4-Aminobenzoic acid butyl ester |
| CAS Registry Number |
94-25-7 |
| Classification |
Pharmaceutical drug, local anesthetic |
| Comments |
Spectrum verified by crosschecking against external libraries (three reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
193.110278725 u |
| Formula |
C11H15NO2 |
| InChI |
InChI=1S/C11H15NO2/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7H,2-3,8,12H2,1H3 |
| InChIKey |
IUWVALYLNVXWKX-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
193.246 g/mol |
| Nominal Mass |
193 u |
| Quality |
926 |
| Retention Index |
1462 |
| SMILES |
NC=1C=CC(C(OCCCC)=O)=CC1 |
| SPLASH |
splash10-00dr-2900000000-2a6b19e09c6876771ee8 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Butamben
Butesine
Butyl 4-amino benzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_018271 |
