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2-({1-[3-(ethoxycarbonyl)-5-ethyl-2-thienyl]-2,5-dioxo-3-pyrrolidinyl}sulfanyl)benzoic acid
SpectraBase Compound ID HEp2hZJOYvp
InChI InChI=1S/C20H19NO6S2/c1-3-11-9-13(20(26)27-4-2)18(28-11)21-16(22)10-15(17(21)23)29-14-8-6-5-7-12(14)19(24)25/h5-9,15H,3-4,10H2,1-2H3,(H,24,25)
InChIKey CRRJBMRWQSJCDD-UHFFFAOYSA-N
Mol Weight 433.49 g/mol
Molecular Formula C20H19NO6S2
Exact Mass 433.06538 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CpZvkN7p8Tc
Name 2-({1-[3-(ethoxycarbonyl)-5-ethyl-2-thienyl]-2,5-dioxo-3-pyrrolidinyl}sulfanyl)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 433.065379678 u
Formula C20H19NO6S2
InChI InChI=1S/C20H19NO6S2/c1-3-11-9-13(20(26)27-4-2)18(28-11)21-16(22)10-15(17(21)23)29-14-8-6-5-7-12(14)19(24)25/h5-9,15H,3-4,10H2,1-2H3,(H,24,25)
InChIKey CRRJBMRWQSJCDD-UHFFFAOYSA-N
Molecular Weight 433.493 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_2567
Solvent DMSO-d6
Source Vendor ID: NMR/12279660