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benzoic acid, 4-[[[5,6-dihydro-2-[(4-pyridinylmethyl)amino]-4H-cyclopenta[b]thien-3-yl]carbonyl]amino]-, ethyl ester
SpectraBase Compound ID LYuesXXER5P
InChI InChI=1S/C23H23N3O3S/c1-2-29-23(28)16-6-8-17(9-7-16)26-21(27)20-18-4-3-5-19(18)30-22(20)25-14-15-10-12-24-13-11-15/h6-13,25H,2-5,14H2,1H3,(H,26,27)
InChIKey LFDDPXFWWPSBMH-UHFFFAOYSA-N
Mol Weight 421.52 g/mol
Molecular Formula C23H23N3O3S
Exact Mass 421.146013 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9PbgLJK0zDc
Name benzoic acid, 4-[[[5,6-dihydro-2-[(4-pyridinylmethyl)amino]-4H-cyclopenta[b]thien-3-yl]carbonyl]amino]-, 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/C23H23N3O3S/c1-2-29-23(28)16-6-8-17(9-7-16)26-21(27)20-18-4-3-5-19(18)30-22(20)25-14-15-10-12-24-13-11-15/h6-13,25H,2-5,14H2,1H3,(H,26,27)
InChIKey LFDDPXFWWPSBMH-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_6676
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/12219985