| SpectraBase Spectrum ID |
3bi91vVSmPT |
| Name |
Thiobenzamide |
| CAS Registry Number |
2227-79-4 |
| Collision Energy |
50 eV |
| Copyright |
Copyright © 2012-2025 Herbert Oberacher. All Rights Reserved. |
| Exact Mass |
137.029920403 u |
| Formula |
C7H7NS |
| InChI |
InChI=1S/C7H7NS/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9) |
| InChIKey |
QIOZLISABUUKJY-UHFFFAOYSA-N |
| Instrument Name |
QStar XL, AB Sciex |
| Ion Polarity |
P |
| Ionization Type |
ESI+ |
| Molecular Weight |
137.200 g/mol |
| Nominal Mass |
137 u |
| Precursor Ion |
[M+H]+ |
| Precursor m/z |
138.037 |
| SMILES |
NC(=S)C1=CC=CC=C1 |
| Selected Ion Charge |
1 |
| Source of Spectrum |
Herbert Oberacher, Institute of Legal Medicine, Innsbruck/Austria |
| Spectrum Type |
ms2 |
| Synonyms |
benzenecarbothioamide |
| Technique |
Q-TOF |
| Wiley ID |
MSforID_+_945.10 |
