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4-(4,5-Dihydro-5-thioxo-1,3,4-thiadiazol-2-yl)-3-methyl-1-phenyl-.delta.2-pyrazolin-5-one
SpectraBase Compound ID KeZK4ReG5CJ
InChI InChI=1S/C12H10N4OS2/c1-7-9(10-13-14-12(18)19-10)11(17)16(15-7)8-5-3-2-4-6-8/h2-6,9H,1H3,(H,14,18)
InChIKey ANTLYEZUCMFOEU-UHFFFAOYSA-N
Mol Weight 290.36 g/mol
Molecular Formula C12H10N4OS2
Exact Mass 290.029603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6tvIoaonioQ
Name 4-(4,5-Dihydro-5-thioxo-1,3,4-thiadiazol-2-yl)-3-methyl-1-phenyl-.delta.2-pyrazolin-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10N4OS2
InChI InChI=1S/C12H10N4OS2/c1-7-9(10-13-14-12(18)19-10)11(17)16(15-7)8-5-3-2-4-6-8/h2-6,9H,1H3,(H,14,18)
InChIKey ANTLYEZUCMFOEU-UHFFFAOYSA-N
Molecular Weight 290.359 g/mol
SMILES N1C(SC(=N1)C1C(N(N=C1C)c1ccccc1)=O)=S
SPLASH splash10-000i-4590000000-a98f10316fa9eda8120d
Source of Spectrum QC-23-45-8
Wiley ID 1583889