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2-Thiazoleacetonitrile, 4-[[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)thio]methyl]-
SpectraBase Compound ID 7wmxYpCtvxG
InChI InChI=1S/C13H10N6S2/c14-7-6-12-15-10(8-20-12)9-21-13-16-17-18-19(13)11-4-2-1-3-5-11/h1-5,8H,6,9H2
InChIKey WPGVXWGBOPEHNV-UHFFFAOYSA-N
Mol Weight 314.39 g/mol
Molecular Formula C13H10N6S2
Exact Mass 314.040837 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2aR3qvClZD8
Name 2-Thiazoleacetonitrile, 4-[[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)thio]methyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10N6S2
InChI InChI=1S/C13H10N6S2/c14-7-6-12-15-10(8-20-12)9-21-13-16-17-18-19(13)11-4-2-1-3-5-11/h1-5,8H,6,9H2
InChIKey WPGVXWGBOPEHNV-UHFFFAOYSA-N
Molecular Weight 314.385 g/mol
SMILES c1ccc(-[n]2c(nnn2)SCc2nc(CC#N)sc2)cc1
SPLASH splash10-0ftb-9300000000-c5d4bcb72bd1d3a3eced
Source of Spectrum IY-1-4549-6
Synonyms 2-[4-[[(1-phenyl-5-tetrazolyl)thio]methyl]-2-thiazolyl]acetonitrile 2-[4-[(1-phenyltetrazol-5-yl)sulfanylmethyl]-1,3-thiazol-2-yl]acetonitrile 2-[4-[(1-phenyltetrazol-5-yl)sulfanylmethyl]thiazol-2-yl]acetonitrile 2-[4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-1,3-thiazol-2-yl]ethanenitrile
Wiley ID 1653479