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N-{3-[(4-methoxyanilino)carbonyl]-5,6-dihydro-4H-cyclopenta[b]thien-2-yl}nicotinamide hydrochloride
SpectraBase Compound ID CXhH1mXF996
InChI InChI=1S/C21H19N3O3S.ClH/c1-27-15-9-7-14(8-10-15)23-20(26)18-16-5-2-6-17(16)28-21(18)24-19(25)13-4-3-11-22-12-13;/h3-4,7-12H,2,5-6H2,1H3,(H,23,26)(H,24,25);1H
InChIKey UTTMZCVXSKACGY-UHFFFAOYSA-N
Mol Weight 429.92 g/mol
Molecular Formula C21H20ClN3O3S
Exact Mass 429.09139 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6QHFnHvVQNM
Name N-{3-[(4-methoxyanilino)carbonyl]-5,6-dihydro-4H-cyclopenta[b]thien-2-yl}nicotinamide hydrochloride
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/C21H19N3O3S.ClH/c1-27-15-9-7-14(8-10-15)23-20(26)18-16-5-2-6-17(16)28-21(18)24-19(25)13-4-3-11-22-12-13;/h3-4,7-12H,2,5-6H2,1H3,(H,23,26)(H,24,25);1H
InChIKey UTTMZCVXSKACGY-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_270
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/6217918; UBI_ID: UBI-000271
Temperature 318 °C