For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1,2,4-Thiadiazole-5-acetonitrile, 3-phenyl-
SpectraBase Compound ID 5wDCyqn0KAF
InChI InChI=1S/C10H7N3S/c11-7-6-9-12-10(13-14-9)8-4-2-1-3-5-8/h1-5H,6H2
InChIKey LGDDSADZQXKYHJ-UHFFFAOYSA-N
Mol Weight 201.25 g/mol
Molecular Formula C10H7N3S
Exact Mass 201.036068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JcGNjDxjKLK
Name 1,2,4-Thiadiazole-5-acetonitrile, 3-phenyl-
Alternate Name(s) (3-phenyl-1,2,4-thiadiazol-5-yl)acetonitrile 3-Phenyl-5-cyanomethyl-1,2,4-thiadiazole 2-(3-phenyl-1,2,4-thiadiazol-5-yl)ethanenitrile
CAS Registry Number 57459-26-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H7N3S
InChI InChI=1S/C10H7N3S/c11-7-6-9-12-10(13-14-9)8-4-2-1-3-5-8/h1-5H,6H2
InChIKey LGDDSADZQXKYHJ-UHFFFAOYSA-N
Molecular Weight 201.247 g/mol
SMILES c1(nc(sn1)CC#N)-c1ccccc1
SPLASH splash10-0f79-1960000000-f12f94f30b837e4721b3
Source of Spectrum J-41-624-0
Wiley ID 1198679