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

*Links on SpectraBase are not permalinks.
1,2,5-Thiadiazole-3-carbonitrile, 4-(trifluoromethyl)-
SpectraBase Compound ID 5aLVmBCuaXJ
InChI InChI=1S/C4F3N3S/c5-4(6,7)3-2(1-8)9-11-10-3
InChIKey OIBTYAHAKJTVGF-UHFFFAOYSA-N
Mol Weight 179.12 g/mol
Molecular Formula C4F3N3S
Exact Mass 178.976503 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 Efsx6INjQSb
Name 1,2,5-Thiadiazole-3-carbonitrile, 4-(trifluoromethyl)-
CAS Registry Number 112390-36-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4F3N3S
InChI InChI=1S/C4F3N3S/c5-4(6,7)3-2(1-8)9-11-10-3
InChIKey OIBTYAHAKJTVGF-UHFFFAOYSA-N
Molecular Weight 179.120 g/mol
SMILES c1(c(nsn1)C#N)C(F)(F)F
SPLASH splash10-004i-5900000000-e17aeb7ac70bfdee5d08
Source of Spectrum KC-1987-1582-13
Synonyms 4-(trifluoromethyl)-1,2,5-thiadiazole-3-carbonitrile
Wiley ID 1174970