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Ethyl (3,5-dimethyl-4-methylthio)benzoate
SpectraBase Compound ID AMMcCelLID1
InChI InChI=1S/C12H16O2S/c1-5-14-12(13)10-6-8(2)11(15-4)9(3)7-10/h6-7H,5H2,1-4H3
InChIKey WEWKDUHBBQKMCR-UHFFFAOYSA-N
Mol Weight 224.32 g/mol
Molecular Formula C12H16O2S
Exact Mass 224.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID u662laJjX
Name Ethyl (3,5-dimethyl-4-methylthio)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2S
InChI InChI=1S/C12H16O2S/c1-5-14-12(13)10-6-8(2)11(15-4)9(3)7-10/h6-7H,5H2,1-4H3
InChIKey WEWKDUHBBQKMCR-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 224.318 g/mol
SMILES CCOC(=O)c1cc(c(c(c1)C)SC)C
SPLASH splash10-00b9-5940000000-dcba745325a01413de35
Source of Spectrum SRH-2022-9638-0
Wiley ID 1831285