For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-Chloro-2,4,5-trimethyl-6-(phenylsulfanyl)benzoic acid methyl ester
SpectraBase Compound ID CEkCjZfeoBE
InChI InChI=1S/C17H17ClO2S/c1-10-11(2)16(21-13-8-6-5-7-9-13)14(17(19)20-4)12(3)15(10)18/h5-9H,1-4H3
InChIKey AKGBMAYFLGUTGF-UHFFFAOYSA-N
Mol Weight 320.83 g/mol
Molecular Formula C17H17ClO2S
Exact Mass 320.063779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID J7cC6yHXGh1
Name 3-Chloro-2,4,5-trimethyl-6-(phenylsulfanyl)benzoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17ClO2S
InChI InChI=1S/C17H17ClO2S/c1-10-11(2)16(21-13-8-6-5-7-9-13)14(17(19)20-4)12(3)15(10)18/h5-9H,1-4H3
InChIKey AKGBMAYFLGUTGF-UHFFFAOYSA-N
Molecular Weight 320.834 g/mol
SMILES c1(c(c(c(C)c(c1C)Cl)C)Sc1ccccc1)C(=O)OC
SPLASH splash10-00dr-0198000000-862d032d2912d250c896
Source of Spectrum F-65-7565-5g
Wiley ID 1680392