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2-Propanone, 1-(9H-[1,2,4]triazolo[4,3-a][1,3]benzimidazol-3-ylthio)-
SpectraBase Compound ID HqLH7WkRvb8
InChI InChI=1S/C11H10N4OS/c1-7(16)6-17-11-14-13-10-12-8-4-2-3-5-9(8)15(10)11/h2-5H,6H2,1H3,(H,12,13)
InChIKey YUSMDBRLCBIPRI-UHFFFAOYSA-N
Mol Weight 246.29 g/mol
Molecular Formula C11H10N4OS
Exact Mass 246.057532 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8LabhGmaQiH
Name 2-Propanone, 1-(9H-[1,2,4]triazolo[4,3-a][1,3]benzimidazol-3-ylthio)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10N4OS
InChI InChI=1S/C11H10N4OS/c1-7(16)6-17-11-14-13-10-12-8-4-2-3-5-9(8)15(10)11/h2-5H,6H2,1H3,(H,12,13)
InChIKey YUSMDBRLCBIPRI-UHFFFAOYSA-N
Molecular Weight 246.288 g/mol
SMILES N1c2[n](-c3ccccc13)c(nn2)SCC(C)=O
SPLASH splash10-0007-9730000000-cd58105a496bed19a87a
Source of Spectrum IY-2-4761-7
Synonyms 1-(3H-[1,2,4]triazolo[4,3-a]benzimidazol-1-ylthio)-2-propanone 1-(3H-[1,2,4]triazolo[4,3-a]benzimidazol-1-ylsulfanyl)propan-2-one
Wiley ID 1655600