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propyl 2-{[(2E)-3-(4-nitrophenyl)-2-propenoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
SpectraBase Compound ID CZelThhfyuJ
InChI InChI=1S/C20H20N2O5S/c1-2-12-27-20(24)18-15-4-3-5-16(15)28-19(18)21-17(23)11-8-13-6-9-14(10-7-13)22(25)26/h6-11H,2-5,12H2,1H3,(H,21,23)/b11-8+
InChIKey JGZULIHWHNHUHH-DHZHZOJOSA-N
Mol Weight 400.45 g/mol
Molecular Formula C20H20N2O5S
Exact Mass 400.109293 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ej64DeN2GZY
Name propyl 2-{[(2E)-3-(4-nitrophenyl)-2-propenoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
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/C20H20N2O5S/c1-2-12-27-20(24)18-15-4-3-5-16(15)28-19(18)21-17(23)11-8-13-6-9-14(10-7-13)22(25)26/h6-11H,2-5,12H2,1H3,(H,21,23)/b11-8+
InChIKey JGZULIHWHNHUHH-DHZHZOJOSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_19757
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: UZI/9129143; Labnumber: U_AM_ACK/012769; UZI_ID: UZI-019765
Synonyms propyl 2-{[3-(4-nitrophenyl)-2-propenoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Temperature 318 °C