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4-(1-Amino-4,5-dihydro-5-thioxo-1,3,4-triazol-2-yl)-3-methyl-1-phenyl-.delta.2-pyrazolin-5-one
SpectraBase Compound ID IAPt03Cd2dv
InChI InChI=1S/C12H12N6OS/c1-7-9(10-14-15-12(20)17(10)13)11(19)18(16-7)8-5-3-2-4-6-8/h2-6,9H,13H2,1H3,(H,15,20)
InChIKey YOLDLKRBULIGLX-UHFFFAOYSA-N
Mol Weight 288.33 g/mol
Molecular Formula C12H12N6OS
Exact Mass 288.07933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4IJLcqfEgv8
Name 4-(1-Amino-4,5-dihydro-5-thioxo-1,3,4-triazol-2-yl)-3-methyl-1-phenyl-.delta.2-pyrazolin-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N6OS
InChI InChI=1S/C12H12N6OS/c1-7-9(10-14-15-12(20)17(10)13)11(19)18(16-7)8-5-3-2-4-6-8/h2-6,9H,13H2,1H3,(H,15,20)
InChIKey YOLDLKRBULIGLX-UHFFFAOYSA-N
Molecular Weight 288.329 g/mol
SMILES N1C(N(C(C2C(N(c3ccccc3)N=C2C)=O)=N1)N)=S
SPLASH splash10-002r-9350000000-dd59886db9581bae96f0
Source of Spectrum QC-23-45-9
Wiley ID 1583888