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3-(chloromethyl)-1,1-bis(oxidanylidene)-2-phenyl-thiochromen-4-one
SpectraBase Compound ID IGjUehl1YBB
InChI InChI=1S/C16H11ClO3S/c17-10-13-15(18)12-8-4-5-9-14(12)21(19,20)16(13)11-6-2-1-3-7-11/h1-9H,10H2
InChIKey DCONAWSZNQVZBJ-UHFFFAOYSA-N
Mol Weight 318.77 g/mol
Molecular Formula C16H11ClO3S
Exact Mass 318.011743 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G87vGBvv7Hb
Name 3-(chloromethyl)-1,1-bis(oxidanylidene)-2-phenyl-thiochromen-4-one
CAS Registry Number 96883-67-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11ClO3S
InChI InChI=1S/C16H11ClO3S/c17-10-13-15(18)12-8-4-5-9-14(12)21(19,20)16(13)11-6-2-1-3-7-11/h1-9H,10H2
InChIKey DCONAWSZNQVZBJ-UHFFFAOYSA-N
Molecular Weight 318.774 g/mol
SMILES C=1(S(c2c(C(C1CCl)=O)cccc2)(=O)=O)c1ccccc1
SPLASH splash10-001i-0091000000-dca4cdf09eced994031f
Source of Spectrum Y-22-1594-10
Synonyms 3-(chloromethyl)-1,1-diketo-2-phenyl-thiochromen-4-one 3-(chloromethyl)-1,1-dioxo-2-phenyl-1-benzothiopyran-4-one 3-(chloromethyl)-1,1-dioxo-2-phenyl-thiochromen-4-one
Wiley ID 1318245