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5-chloro-3-methylbenzo[b]thien-2-yl (phenylthio)methyl ketone
SpectraBase Compound ID 9xcoa66NJSE
InChI InChI=1S/C17H13ClOS2/c1-11-14-9-12(18)7-8-16(14)21-17(11)15(19)10-20-13-5-3-2-4-6-13/h2-9H,10H2,1H3
InChIKey FEGUFLXGWYVTDV-UHFFFAOYSA-N
Mol Weight 332.86 g/mol
Molecular Formula C17H13ClOS2
Exact Mass 332.009635 g/mol

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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 37EEH3jwUI4
Name 5-CHLORO-3-METHYLBENZO[b]THIEN-2-YL (PHENYLTHIO)METHYL KETONE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13ClOS2
InChI InChI=1S/C17H13ClOS2/c1-11-14-9-12(18)7-8-16(14)21-17(11)15(19)10-20-13-5-3-2-4-6-13/h2-9H,10H2,1H3
InChIKey FEGUFLXGWYVTDV-UHFFFAOYSA-N
Melting Point 114-115C
Molecular Weight 332.87
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms KETONE, 5-CHLORO-3-METHYLBENZO[b]THIEN-2-YL (PHENYLTHIO)METHYL,