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Methyl 4-(methylsulfinyl)benzoate
SpectraBase Compound ID 4wWZOt0cDnG
InChI InChI=1S/C9H10O3S/c1-12-9(10)7-3-5-8(6-4-7)13(2)11/h3-6H,1-2H3
InChIKey DZWCSSHXJQPVSW-UHFFFAOYSA-N
Mol Weight 198.24 g/mol
Molecular Formula C9H10O3S
Exact Mass 198.035065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C9NgxJ53Q
Name Methyl 4-(methylsulfinyl)benzoate
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O3S
InChI InChI=1S/C9H10O3S/c1-12-9(10)7-3-5-8(6-4-7)13(2)11/h3-6H,1-2H3
InChIKey DZWCSSHXJQPVSW-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202100063
Molecular Weight 198.236 g/mol
SMILES c1c(S(C)=O)ccc(c1)C(=O)OC
SPLASH splash10-0ue9-0900000000-dcd08728ac13133fe74a
Source of Spectrum AJO-10-SM14-3e
Wiley ID 1866304