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2-(2-(4,5-Dihydro-4-methyl-5-oxo-[1,2,4]triazolo[4,3-a]quinazolin-1-ylthio)acetamido)-4-methylpentanehydrazide
SpectraBase Compound ID DaBBrkYPeH9
InChI InChI=1S/C18H23N7O3S/c1-10(2)8-12(15(27)21-19)20-14(26)9-29-18-23-22-17-24(3)16(28)11-6-4-5-7-13(11)25(17)18/h4-7,10,12H,8-9,19H2,1-3H3,(H,20,26)(H,21,27)
InChIKey ZPEZPJRXFSUDRM-UHFFFAOYSA-N
Mol Weight 417.49 g/mol
Molecular Formula C18H23N7O3S
Exact Mass 417.158309 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ULKTtx94MI
Name 2-(2-(4,5-Dihydro-4-methyl-5-oxo-[1,2,4]triazolo[4,3-a]quinazolin-1-ylthio)acetamido)-4-methylpentanehydrazide
Appearance Colorless crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23N7O3S
InChI InChI=1S/C18H23N7O3S/c1-10(2)8-12(15(27)21-19)20-14(26)9-29-18-23-22-17-24(3)16(28)11-6-4-5-7-13(11)25(17)18/h4-7,10,12H,8-9,19H2,1-3H3,(H,20,26)(H,21,27)
InChIKey ZPEZPJRXFSUDRM-UHFFFAOYSA-N
Instrument Name KRATOS Analytical Kompact
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0008.g18
Molecular Weight 417.488 g/mol
SMILES N(C(CSc1[n]-2c(N(C)C(c3ccccc23)=O)nn1)=O)C(C(=O)NN)CC(C)C
SPLASH splash10-0089-1390000000-ceca1b8d16b93923043e
Source of Spectrum ARK-2007-183-10e
Wiley ID 1868997