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4-N-Phenyl-4-N-methyl-1-[(5-chlorothien-2-yl)carbonyl]thiosemicarbazide
SpectraBase Compound ID 9ComrK4FqHn
InChI InChI=1S/C13H12ClN3OS2/c1-17(9-5-3-2-4-6-9)13(19)16-15-12(18)10-7-8-11(14)20-10/h2-8H,1H3,(H,15,18)(H,16,19)
InChIKey XHFFMCPUKAEJSU-UHFFFAOYSA-N
Mol Weight 325.83 g/mol
Molecular Formula C13H12ClN3OS2
Exact Mass 325.011032 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 594rOLOBqDE
Name 4-N-Phenyl-4-N-methyl-1-[(5-chlorothien-2-yl)carbonyl]thiosemicarbazide
Alternate Name(s) 2-[(5-chloro-2-thienyl)carbonyl]-N-methyl-N-phenylhydrazinecarbothioamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12ClN3OS2
InChI InChI=1S/C13H12ClN3OS2/c1-17(9-5-3-2-4-6-9)13(19)16-15-12(18)10-7-8-11(14)20-10/h2-8H,1H3,(H,15,18)(H,16,19)
InChIKey XHFFMCPUKAEJSU-UHFFFAOYSA-N
Molecular Weight 325.832 g/mol
SMILES N(NC(N(c1ccccc1)C)=S)C(c1sc(Cl)cc1)=O
SPLASH splash10-0aor-0891000000-e2da6f372e8dc70c2480
Source of Spectrum F4-0-2391-6
Wiley ID 1618577