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4,6-Dimethyl-2-(4-chlorophenylsulfanyl)benzoic acid methyl ester
SpectraBase Compound ID AueYuCOxM1y
InChI InChI=1S/C16H15ClO2S/c1-10-8-11(2)15(16(18)19-3)14(9-10)20-13-6-4-12(17)5-7-13/h4-9H,1-3H3
InChIKey HVPWGBABNPYTIV-UHFFFAOYSA-N
Mol Weight 306.81 g/mol
Molecular Formula C16H15ClO2S
Exact Mass 306.048129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KaWWJY5YZwW
Name 4,6-Dimethyl-2-(4-chlorophenylsulfanyl)benzoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15ClO2S
InChI InChI=1S/C16H15ClO2S/c1-10-8-11(2)15(16(18)19-3)14(9-10)20-13-6-4-12(17)5-7-13/h4-9H,1-3H3
InChIKey HVPWGBABNPYTIV-UHFFFAOYSA-N
Molecular Weight 306.807 g/mol
SMILES c1(c(Sc2ccc(cc2)Cl)cc(cc1C)C)C(=O)OC
SPLASH splash10-0pb9-0095000000-0d8f3a8d9c67413323d3
Source of Spectrum F-65-7567-5q
Wiley ID 1680434