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4-({3-[(4-methoxyanilino)carbonyl]-5,6-dihydro-4H-cyclopenta[b]thien-2-yl}amino)-4-oxobutanoic acid
SpectraBase Compound ID 7CdRix2IBoE
InChI InChI=1S/C19H20N2O5S/c1-26-12-7-5-11(6-8-12)20-18(25)17-13-3-2-4-14(13)27-19(17)21-15(22)9-10-16(23)24/h5-8H,2-4,9-10H2,1H3,(H,20,25)(H,21,22)(H,23,24)
InChIKey LODBTPPQPALKGX-UHFFFAOYSA-N
Mol Weight 388.44 g/mol
Molecular Formula C19H20N2O5S
Exact Mass 388.109293 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4v4T2HOw2qi
Name 4-({3-[(4-methoxyanilino)carbonyl]-5,6-dihydro-4H-cyclopenta[b]thien-2-yl}amino)-4-oxobutanoic acid
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/C19H20N2O5S/c1-26-12-7-5-11(6-8-12)20-18(25)17-13-3-2-4-14(13)27-19(17)21-15(22)9-10-16(23)24/h5-8H,2-4,9-10H2,1H3,(H,20,25)(H,21,22)(H,23,24)
InChIKey LODBTPPQPALKGX-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1021
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: /VSVE61145; UBI_ID: UBI-001022
Temperature 318 °C