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5-(Methylthio)-2-(cyanomethyl0-1,2,4-triazolo[1,5-c]quinazoline
SpectraBase Compound ID 3xfWNmpFaE
InChI InChI=1S/C12H9N5S/c1-18-12-14-9-5-3-2-4-8(9)11-15-10(6-7-13)16-17(11)12/h2-5H,6H2,1H3
InChIKey JVVRSGYVNWOIFA-UHFFFAOYSA-N
Mol Weight 255.3 g/mol
Molecular Formula C12H9N5S
Exact Mass 255.057866 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1UBf7SmkRu0
Name 5-(Methylthio)-2-(cyanomethyl0-1,2,4-triazolo[1,5-c]quinazoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9N5S
InChI InChI=1S/C12H9N5S/c1-18-12-14-9-5-3-2-4-8(9)11-15-10(6-7-13)16-17(11)12/h2-5H,6H2,1H3
InChIKey JVVRSGYVNWOIFA-UHFFFAOYSA-N
Molecular Weight 255.299 g/mol
SMILES c-12[n](nc(n2)CC#N)C(=Nc2ccccc12)SC
SPLASH splash10-056r-9050000000-cc30e8a48b224a8ecf80
Source of Spectrum K1-2003-186-4
Synonyms 2-(5-Methylsulfanyl-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)acetonitrile 2-(5-Methylsulfanyl-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)ethanenitrile
Wiley ID 1520537