| SpectraBase Spectrum ID |
5VsiJOn59Tk |
| Name |
Phenylisothiocyanate |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
135.014270339 u |
| Formula |
C7H5NS |
| InChI |
InChI=1S/C7H5NS/c9-6-8-7-4-2-1-3-5-7/h1-5H |
| InChIKey |
QKFJKGMPGYROCL-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
135.184 g/mol |
| Nominal Mass |
135 u |
| Quality |
809 |
| Retention Index |
1012 |
| SMILES |
C1(=CC=CC=C1)N=C=S |
| SPLASH |
splash10-0fbi-9500000000-5c71fa85424b473b8c76 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Thiocarbanil
Isothiocyanatobenzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_013851 |
