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acetonitrile, [(5,6,7-trimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)thio]-
SpectraBase Compound ID L2inEKEM7M3
InChI InChI=1S/C10H11N5S/c1-6-7(2)12-9-13-10(16-5-4-11)14-15(9)8(6)3/h5H2,1-3H3
InChIKey QIWMTPDXFYURHS-UHFFFAOYSA-N
Mol Weight 233.29 g/mol
Molecular Formula C10H11N5S
Exact Mass 233.073517 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IXlgv2gDPQ5
Name 2-[(5,6,7-trimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]acetonitrile
Alternate Name(s) 2-[(5,6,7-trimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]ethanenitrile 2-[(5,6,7-trimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)thio]acetonitrile
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Formula C10H11N5S
InChI InChI=1S/C10H11N5S/c1-6-7(2)12-9-13-10(16-5-4-11)14-15(9)8(6)3/h5H2,1-3H3
InChIKey QIWMTPDXFYURHS-UHFFFAOYSA-N
Molecular Weight 233.293 g/mol
SMILES c12[n](C(C)=C(C(=N2)C)C)nc(n1)SCC#N
SPLASH splash10-01q9-7960000000-cbeab94135c96ed3f470
Wiley ID 1466022