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3,4,6-Trimethyl-2-(4-chlorophenylsulfanyl)benzoic acid methyl ester
SpectraBase Compound ID JxO0YtmbLaE
InChI InChI=1S/C17H17ClO2S/c1-10-9-11(2)15(17(19)20-4)16(12(10)3)21-14-7-5-13(18)6-8-14/h5-9H,1-4H3
InChIKey CCULNFOTQKUAIQ-UHFFFAOYSA-N
Mol Weight 320.83 g/mol
Molecular Formula C17H17ClO2S
Exact Mass 320.063779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 94Hj1f8rDWL
Name 3,4,6-Trimethyl-2-(4-chlorophenylsulfanyl)benzoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17ClO2S
InChI InChI=1S/C17H17ClO2S/c1-10-9-11(2)15(17(19)20-4)16(12(10)3)21-14-7-5-13(18)6-8-14/h5-9H,1-4H3
InChIKey CCULNFOTQKUAIQ-UHFFFAOYSA-N
Molecular Weight 320.834 g/mol
SMILES c1(c(c(C)c(cc1C)C)Sc1ccc(Cl)cc1)C(=O)OC
SPLASH splash10-00di-0059000000-43c681b963635ca90325
Source of Spectrum F-65-7567-5s
Wiley ID 1680429