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4-{[(4,5-dichloro-3-isothiazolyl)carbonyl]amino}benzoic acid
SpectraBase Compound ID 5l926WWBrN1
InChI InChI=1S/C11H6Cl2N2O3S/c12-7-8(15-19-9(7)13)10(16)14-6-3-1-5(2-4-6)11(17)18/h1-4H,(H,14,16)(H,17,18)
InChIKey WCLKZMZUEJUWHF-UHFFFAOYSA-N
Mol Weight 317.15 g/mol
Molecular Formula C11H6Cl2N2O3S
Exact Mass 315.947619 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 28AZs6GGXUM
Name 4-{[(4,5-dichloro-3-isothiazolyl)carbonyl]amino}benzoic acid
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 315.947618632 u
Formula C11H6Cl2N2O3S
InChI InChI=1S/C11H6Cl2N2O3S/c12-7-8(15-19-9(7)13)10(16)14-6-3-1-5(2-4-6)11(17)18/h1-4H,(H,14,16)(H,17,18)
InChIKey WCLKZMZUEJUWHF-UHFFFAOYSA-N
Molecular Weight 317.146 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_4150
Solvent DMSO-d6
Source Vendor ID: NMR/12308802