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Methyl (E)-N-(2,4,6-trichlorophenyl)benzimidothioate
SpectraBase Compound ID Hm6mgGZxUx8
InChI InChI=1S/C14H10Cl3NS/c1-19-14(9-5-3-2-4-6-9)18-13-11(16)7-10(15)8-12(13)17/h2-8H,1H3/b18-14+
InChIKey HUHICMITBIWCRC-NBVRZTHBSA-N
Mol Weight 330.66 g/mol
Molecular Formula C14H10Cl3NS
Exact Mass 328.959954 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4CWRTmcrLc
Name Methyl (E)-N-(2,4,6-trichlorophenyl)benzimidothioate
Appearance Orange oil
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Formula C14H10Cl3NS
InChI InChI=1S/C14H10Cl3NS/c1-19-14(9-5-3-2-4-6-9)18-13-11(16)7-10(15)8-12(13)17/h2-8H,1H3/b18-14+
InChIKey HUHICMITBIWCRC-NBVRZTHBSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90
Ionization Type EI
Literature Reference DOI 10.1002/chem.201900903
Molecular Weight 330.660 g/mol
Quality 265
Reported Formula C14H10N(35)Cl3S
SMILES C1(=CC(=C(C(=C1)Cl)\N=C/(SC)C=1C=CC=CC1)Cl)Cl
SPLASH splash10-001i-0090000000-fcd9562bfb267f121c62
Source of Spectrum QE-25-SM11-4a (DOI: 10.1002/chem.201900903)
Wiley ID 1893789