| SpectraBase Spectrum ID |
SpM0qC9WnS |
| Name |
Thiocyanic acid, 2-(isothiocyanatomethyl)phenyl ester |
| Alternate Name(s) |
2-(isothiocyanatomethyl)phenyl thiocyanate
O-thiocyanato-benzyl isothiocyanate |
| CAS Registry Number |
78672-48-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H6N2S2 |
| InChI |
InChI=1S/C9H6N2S2/c10-6-13-9-4-2-1-3-8(9)5-11-7-12/h1-4H,5H2 |
| InChIKey |
QIOUHQHOJWVCBC-UHFFFAOYSA-N |
| Molecular Weight |
206.281 g/mol |
| SMILES |
C(#N)Sc1c(CN=C=S)cccc1 |
| SPLASH |
splash10-00dj-0900000000-dbfcf7a9a6a1e49e1e93 |
| Source of Spectrum |
J-50-183-6 |
| Wiley ID |
1203914 |
