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methyl 2-{[(4-benzyl-1-piperidinyl)carbothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 2YKeoanL1CX
InChI InChI=1S/C23H28N2O2S2/c1-27-22(26)20-18-9-5-6-10-19(18)29-21(20)24-23(28)25-13-11-17(12-14-25)15-16-7-3-2-4-8-16/h2-4,7-8,17H,5-6,9-15H2,1H3,(H,24,28)
InChIKey DRQKTXJMABDRTI-UHFFFAOYSA-N
Mol Weight 428.61 g/mol
Molecular Formula C23H28N2O2S2
Exact Mass 428.15922 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8b2etVpdZqv
Name methyl 2-{[(4-benzyl-1-piperidinyl)carbothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-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/C23H28N2O2S2/c1-27-22(26)20-18-9-5-6-10-19(18)29-21(20)24-23(28)25-13-11-17(12-14-25)15-16-7-3-2-4-8-16/h2-4,7-8,17H,5-6,9-15H2,1H3,(H,24,28)
InChIKey DRQKTXJMABDRTI-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7828
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/1269687; Labnumber: COL6196; UZI_ID: UZI-007830
Temperature 318 °C