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1,2,3-Thiadiazole, propanenitrile deriv.
SpectraBase Compound ID B6f9CJ6BVTS
InChI InChI=1S/C11H9N3S2/c12-8-4-7-10-11(13-14-16-10)15-9-5-2-1-3-6-9/h1-3,5-6H,4,7H2
InChIKey FTONIVHTJGGYEN-UHFFFAOYSA-N
Mol Weight 247.33 g/mol
Molecular Formula C11H9N3S2
Exact Mass 247.02379 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IndizKmVfOE
Name 1,2,3-Thiadiazole, propanenitrile deriv.
Alternate Name(s) Propanenitrile, 3-[(5-phenyl-1,2,3-thiadiazol-4-yl)thio]- 3-[4-(phenylsulfanyl)-1,2,3-thiadiazol-5-yl]propanenitrile 4-Phenylthio-5-cyanoethyl-1,2,3-thiadiazole
CAS Registry Number 114393-83-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H9N3S2
InChI InChI=1S/C11H9N3S2/c12-8-4-7-10-11(13-14-16-10)15-9-5-2-1-3-6-9/h1-3,5-6H,4,7H2
InChIKey FTONIVHTJGGYEN-UHFFFAOYSA-N
Molecular Weight 247.334 g/mol
SMILES c1(nnsc1CCC#N)Sc1ccccc1
SPLASH splash10-00di-0910000000-a3f7c974ee685deae1f7
Source of Spectrum Y-25-1881-3
Wiley ID 1249789