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o-(benzylsulfinyl)benzoic acid, methyl ester

View entire compound with spectra: 2 NMR, and 1 FTIR

o-(benzylsulfinyl)benzoic acid, methyl ester
SpectraBase Compound ID D6anDOJgtax
InChI InChI=1S/C15H14O3S/c1-18-15(16)13-9-5-6-10-14(13)19(17)11-12-7-3-2-4-8-12/h2-10H,11H2,1H3
InChIKey MLXPREWDKMMTKO-UHFFFAOYSA-N
Mol Weight 274.33 g/mol
Molecular Formula C15H14O3S
Exact Mass 274.066365 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9ptGOMfUKvS
Name o-(BENZYLSULFINYL)BENZOIC ACID, METHYL ESTER
Source of Sample B. Stridsberg, University of Uppsala, Uppsala, Sweden
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14O3S
InChI InChI=1S/C15H14O3S/c1-18-15(16)13-9-5-6-10-14(13)19(17)11-12-7-3-2-4-8-12/h2-10H,11H2,1H3
InChIKey MLXPREWDKMMTKO-UHFFFAOYSA-N
Melting Point 121-122C
Molecular Weight 274.34
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms BENZOIC ACID, O-/BENZYLSULFINYL/-, METHYL ESTER