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3,4,6-Trimethyl-2-(4-tolylsulfanyl)benzoic acid methyl ester

View entire compound with spectra: 1 MS (GC)

3,4,6-Trimethyl-2-(4-tolylsulfanyl)benzoic acid methyl ester
SpectraBase Compound ID HrIYE0P1wr1
InChI InChI=1S/C18H20O2S/c1-11-6-8-15(9-7-11)21-17-14(4)12(2)10-13(3)16(17)18(19)20-5/h6-10H,1-5H3
InChIKey RVVSCODCRVQITJ-UHFFFAOYSA-N
Mol Weight 300.42 g/mol
Molecular Formula C18H20O2S
Exact Mass 300.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FlV6H8JECSr
Name 3,4,6-Trimethyl-2-(4-tolylsulfanyl)benzoic acid methyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O2S
InChI InChI=1S/C18H20O2S/c1-11-6-8-15(9-7-11)21-17-14(4)12(2)10-13(3)16(17)18(19)20-5/h6-10H,1-5H3
InChIKey RVVSCODCRVQITJ-UHFFFAOYSA-N
Molecular Weight 300.416 g/mol
SMILES c1(c(c(C)c(cc1C)C)Sc1ccc(cc1)C)C(=O)OC
SPLASH splash10-0udi-0094000000-2ca416d6e9354f3c14c0
Source of Spectrum F-65-7566-5m
Wiley ID 1680438