| SpectraBase Spectrum ID |
9PiJmaiegI8 |
| Name |
4-Phenyl-3-thiosemicarbazide |
| CAS Registry Number |
5351-69-9 |
| Collision Energy |
45 eV |
| Copyright |
Copyright © 2012-2025 Herbert Oberacher. All Rights Reserved. |
| Exact Mass |
167.051718476 u |
| Formula |
C7H9N3S |
| InChI |
InChI=1S/C7H9N3S/c8-10-7(11)9-6-4-2-1-3-5-6/h1-5H,8H2,(H2,9,10,11) |
| InChIKey |
KKIGUVBJOHCXSP-UHFFFAOYSA-N |
| Instrument Name |
QStar XL, AB Sciex |
| Ion Polarity |
P |
| Ionization Type |
ESI+ |
| Molecular Weight |
167.230 g/mol |
| Nominal Mass |
167 u |
| Precursor Ion |
[M+H]+ |
| Precursor m/z |
168.059 |
| SMILES |
N(C1=CC=CC=C1)C(=S)NN |
| Selected Ion Charge |
1 |
| Source of Spectrum |
Herbert Oberacher, Institute of Legal Medicine, Innsbruck/Austria |
| Spectrum Type |
ms2 |
| Synonyms |
1-amino-3-phenylthiourea |
| Technique |
Q-TOF |
| Wiley ID |
MSforID_+_749.8 |
