| SpectraBase Spectrum ID |
3qjg3qO1aEm |
| Name |
Benzocaine |
| CAS Registry Number |
94-09-7 |
| Collision Energy |
20 eV |
| Copyright |
Copyright © 2012-2025 Herbert Oberacher. All Rights Reserved. |
| Exact Mass |
165.078978596 u |
| Formula |
C9H11NO2 |
| InChI |
InChI=1S/C9H11NO2/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6H,2,10H2,1H3 |
| InChIKey |
BLFLLBZGZJTVJG-UHFFFAOYSA-N |
| Instrument Name |
QStar XL, AB Sciex |
| Ion Polarity |
P |
| Ionization Type |
ESI+ |
| Molecular Weight |
165.192 g/mol |
| Nominal Mass |
165 u |
| Precursor Ion |
[M+H]+ |
| Precursor m/z |
166.086 |
| SMILES |
NC1=CC=C(C=C1)C(OCC)=O |
| Selected Ion Charge |
1 |
| Source of Spectrum |
Herbert Oberacher, Institute of Legal Medicine, Innsbruck/Austria |
| Spectrum Type |
ms2 |
| Synonyms |
ethyl 4-aminobenzoate |
| Technique |
Q-TOF |
| Wiley ID |
MSforID_+_92.3 |
