For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

2-chloro-5-methylsulfanylbenzoic acid

View entire compound with spectra: 3 NMR, and 1 FTIR

2-chloro-5-methylsulfanylbenzoic acid
SpectraBase Compound ID EwIYifgqEFd
InChI InChI=1S/C8H7ClO2S/c1-12-5-2-3-7(9)6(4-5)8(10)11/h2-4H,1H3,(H,10,11)
InChIKey HJDZJDJRUVAYTR-UHFFFAOYSA-N
Mol Weight 202.65 g/mol
Molecular Formula C8H7ClO2S
Exact Mass 201.985528 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1BmPSdChvgS
Name 2-Chloro-5-(methylthio)benzoic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 245380
CAS Registry Number 51546-12-4
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7ClO2S
InChI InChI=1S/C8H7ClO2S/c1-12-5-2-3-7(9)6(4-5)8(10)11/h2-4H,1H3,(H,10,11)
InChIKey HJDZJDJRUVAYTR-UHFFFAOYSA-N
Observed nucleus 13C
Purity 96%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_004076