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N-[(2-Chlorophenyl)(methyl)(oxo)-lamda6-sulfaneylidene]-3-phenylpropiolamide
SpectraBase Compound ID KtcSX5XsuTJ
InChI InChI=1S/C16H12ClNO2S/c1-21(20,15-10-6-5-9-14(15)17)18-16(19)12-11-13-7-3-2-4-8-13/h2-10H,1H3
InChIKey XFUIBANRBMGQOQ-UHFFFAOYSA-N
Mol Weight 317.79 g/mol
Molecular Formula C16H12ClNO2S
Exact Mass 317.027728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID e2gIP1jw7K
Name N-[(2-Chlorophenyl)(methyl)(oxo)-lamda6-sulfaneylidene]-3-phenylpropiolamide
Appearance Orange oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12ClNO2S
InChI InChI=1S/C16H12ClNO2S/c1-21(20,15-10-6-5-9-14(15)17)18-16(19)12-11-13-7-3-2-4-8-13/h2-10H,1H3
InChIKey XFUIBANRBMGQOQ-UHFFFAOYSA-N
Instrument Name Finnigan SSQ-7000
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202001440
Molecular Weight 317.790 g/mol
Reported Formula C16H12ClNO2S
SMILES c1cc(c(cc1)Cl)S(=NC(C#Cc1ccccc1)=O)(C)=O
SPLASH splash10-004i-0960000000-f1827a7eadb180351cc1
Source of Spectrum ASC-363-SM10-2ao
Wiley ID 1856400