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thieno[2,3-c]pyridine-3,6(5H)-dicarboxylic acid, 2-[[(4-chlorophenoxy)acetyl]amino]-4,7-dihydro-, diethyl ester
SpectraBase Compound ID KwdxNFLsW80
InChI InChI=1S/C21H23ClN2O6S/c1-3-28-20(26)18-15-9-10-24(21(27)29-4-2)11-16(15)31-19(18)23-17(25)12-30-14-7-5-13(22)6-8-14/h5-8H,3-4,9-12H2,1-2H3,(H,23,25)
InChIKey KPSHNWOSSDLYOC-UHFFFAOYSA-N
Mol Weight 466.94 g/mol
Molecular Formula C21H23ClN2O6S
Exact Mass 466.096535 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CS9JSoWELv3
Name thieno[2,3-c]pyridine-3,6(5H)-dicarboxylic acid, 2-[[(4-chlorophenoxy)acetyl]amino]-4,7-dihydro-, diethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 466.096535337 u
Formula C21H23ClN2O6S
InChI InChI=1S/C21H23ClN2O6S/c1-3-28-20(26)18-15-9-10-24(21(27)29-4-2)11-16(15)31-19(18)23-17(25)12-30-14-7-5-13(22)6-8-14/h5-8H,3-4,9-12H2,1-2H3,(H,23,25)
InChIKey KPSHNWOSSDLYOC-UHFFFAOYSA-N
Molecular Weight 466.936 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_3865
Solvent DMSO-d6
Source Vendor ID: NMR/9243925; Lab Info: DEC; Lab Number: DEC-S000011
Temperature 29.85 °C