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2-Methylsulfinyl-benzoic acid

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2-Methylsulfinyl-benzoic acid
SpectraBase Compound ID 1Vwnqy6xwSD
InChI InChI=1S/C8H8O3S/c1-12(11)7-5-3-2-4-6(7)8(9)10/h2-5H,1H3,(H,9,10)
InChIKey JVYFTEBQXOBPAB-UHFFFAOYSA-N
Mol Weight 184.21 g/mol
Molecular Formula C8H8O3S
Exact Mass 184.019415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2gjRcJp5q2V
Name 2-Methylsulfinyl-benzoic acid
CAS Registry Number 19093-34-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H8O3S
InChI InChI=1S/C8H8O3S/c1-12(11)7-5-3-2-4-6(7)8(9)10/h2-5H,1H3,(H,9,10)
InChIKey JVYFTEBQXOBPAB-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference W. Nakanishi, Y. Ikeda, H. Iwamura, Org. Magn. Resonance 20, 117 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD3OD