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3-amino-2-[(3,5-dichloroanilino)carbonyl]-6-oxo-6,7-dihydrothieno[2,3-b]pyridine-5-carboxylic acid
SpectraBase Compound ID 22cQOvKefI2
InChI InChI=1S/C15H9Cl2N3O4S/c16-5-1-6(17)3-7(2-5)19-13(22)11-10(18)8-4-9(15(23)24)12(21)20-14(8)25-11/h1-4H,18H2,(H,19,22)(H,20,21)(H,23,24)
InChIKey APMQETKNPKQVAU-UHFFFAOYSA-N
Mol Weight 398.22 g/mol
Molecular Formula C15H9Cl2N3O4S
Exact Mass 396.969082 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1sytGcYuI9q
Name 3-amino-2-[(3,5-dichloroanilino)carbonyl]-6-oxo-6,7-dihydrothieno[2,3-b]pyridine-5-carboxylic 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 396.969082352 u
Formula C15H9Cl2N3O4S
InChI InChI=1S/C15H9Cl2N3O4S/c16-5-1-6(17)3-7(2-5)19-13(22)11-10(18)8-4-9(15(23)24)12(21)20-14(8)25-11/h1-4H,18H2,(H,19,22)(H,20,21)(H,23,24)
InChIKey APMQETKNPKQVAU-UHFFFAOYSA-N
Molecular Weight 398.220 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_2528
Solvent DMSO-d6
Source Vendor ID: NMR/12279580