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1-[(3-Chlorophenyl)carbonyl]-4-(4-iodophenyl)thiosemicarbazide
SpectraBase Compound ID 3o27ZgGiFke
InChI InChI=1S/C14H11ClIN3OS/c15-10-3-1-2-9(8-10)13(20)18-19-14(21)17-12-6-4-11(16)5-7-12/h1-8H,(H,18,20)(H2,17,19,21)
InChIKey YOJPBYWPQQFNLH-UHFFFAOYSA-N
Mol Weight 431.68 g/mol
Molecular Formula C14H11ClIN3OS
Exact Mass 430.935606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1HxNARevChd
Name 1-[(3-Chlorophenyl)carbonyl]-4-(4-iodophenyl)thiosemicarbazide
Alternate Name(s) 1-[[(3-chlorophenyl)-oxomethyl]amino]-3-(4-iodophenyl)thiourea 1-[(3-chlorophenyl)carbonylamino]-3-(4-iodophenyl)thiourea
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Formula C14H11ClIN3OS
InChI InChI=1S/C14H11ClIN3OS/c15-10-3-1-2-9(8-10)13(20)18-19-14(21)17-12-6-4-11(16)5-7-12/h1-8H,(H,18,20)(H2,17,19,21)
InChIKey YOJPBYWPQQFNLH-UHFFFAOYSA-N
Molecular Weight 431.679 g/mol
SMILES N(NC(c1cc(Cl)ccc1)=O)C(Nc1ccc(cc1)I)=S
SPLASH splash10-03dr-4970000000-1ba3d25b352dc1929476
Source of Spectrum F2-46-245-6
Wiley ID 1689824