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3-chloro-6-methyl-1-benzothiophene-2-carboxylic acid

View entire compound with spectra: 1 NMR

3-chloro-6-methyl-1-benzothiophene-2-carboxylic acid
SpectraBase Compound ID 4p6ijyV1eA9
InChI InChI=1S/C10H7ClO2S/c1-5-2-3-6-7(4-5)14-9(8(6)11)10(12)13/h2-4H,1H3,(H,12,13)
InChIKey KWGVHWHFCFSQAZ-UHFFFAOYSA-N
Mol Weight 226.68 g/mol
Molecular Formula C10H7ClO2S
Exact Mass 225.985528 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 76ldkRHpwUI
Name 3-chloro-6-methyl-1-benzothiophene-2-carboxylic acid
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C10H7ClO2S/c1-5-2-3-6-7(4-5)14-9(8(6)11)10(12)13/h2-4H,1H3,(H,12,13)
InChIKey KWGVHWHFCFSQAZ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_15361
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/6218990; UBI_ID: UBI-015364
Temperature 308 °C