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3-CHLORO-4-METHYL-BENZENESULFONIC-ACID

View entire compound with spectra: 2 NMR

3-CHLORO-4-METHYL-BENZENESULFONIC-ACID
SpectraBase Compound ID 8bGBGa0spoV
InChI InChI=1S/C7H7ClO3S/c1-5-2-3-6(4-7(5)8)12(9,10)11/h2-4H,1H3,(H,9,10,11)
InChIKey UPMIEBBZKWZYEZ-UHFFFAOYSA-N
Mol Weight 206.64 g/mol
Molecular Formula C7H7ClO3S
Exact Mass 205.980443 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9lUQH6Xzrqj
Name 3-CHLORO-4-METHYL-BENZENSULFONIC-ACID;2-CHLOROTOLUEN-4-SULFONIC-ACID
Compound Number 1874
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H7ClO3S
InChI InChI=1S/C7H7ClO3S/c1-5-2-3-6(4-7(5)8)12(9,10)11/h2-4H,1H3,(H,9,10,11)
InChIKey UPMIEBBZKWZYEZ-UHFFFAOYSA-N
Literature Reference Author W.ROBIEN
Literature Reference Citation W.ROBIEN,PRIVATE_COMMUNICATION
Molecular Weight 206.644 g/mol
Sample ID 264
Solvent DMSO-D6