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4H-cyclopenta[b]thiophene-3-carboxylic acid, 2-[[(2E)-3-(3-bromo-4-methoxyphenyl)-1-oxo-2-propenyl]amino]-5,6-dihydro-, ethyl ester

View entire compound with spectra: 1 NMR

4H-cyclopenta[b]thiophene-3-carboxylic acid, 2-[[(2E)-3-(3-bromo-4-methoxyphenyl)-1-oxo-2-propenyl]amino]-5,6-dihydro-, ethyl ester
SpectraBase Compound ID LLaCnWR7Ldg
InChI InChI=1S/C20H20BrNO4S/c1-3-26-20(24)18-13-5-4-6-16(13)27-19(18)22-17(23)10-8-12-7-9-15(25-2)14(21)11-12/h7-11H,3-6H2,1-2H3,(H,22,23)/b10-8+
InChIKey FHWSAHICABDYJL-CSKARUKUSA-N
Mol Weight 450.35 g/mol
Molecular Formula C20H20BrNO4S
Exact Mass 449.029642 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Dy1KEfW6A2d
Name 4H-cyclopenta[b]thiophene-3-carboxylic acid, 2-[[(2E)-3-(3-bromo-4-methoxyphenyl)-1-oxo-2-propenyl]amino]-5,6-dihydro-, ethyl ester
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/C20H20BrNO4S/c1-3-26-20(24)18-13-5-4-6-16(13)27-19(18)22-17(23)10-8-12-7-9-15(25-2)14(21)11-12/h7-11H,3-6H2,1-2H3,(H,22,23)/b10-8+
InChIKey FHWSAHICABDYJL-CSKARUKUSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_3693
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: NMR/10238487