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methyl 2-[({[1-(4-methylphenyl)ethyl]amino}carbothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID Kp7peFGhgJr
InChI InChI=1S/C20H24N2O2S2/c1-12-8-10-14(11-9-12)13(2)21-20(25)22-18-17(19(23)24-3)15-6-4-5-7-16(15)26-18/h8-11,13H,4-7H2,1-3H3,(H2,21,22,25)
InChIKey PQSYTNFKMJHHOA-UHFFFAOYSA-N
Mol Weight 388.54 g/mol
Molecular Formula C20H24N2O2S2
Exact Mass 388.12792 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CqtTGQen6Gd
Name methyl 2-[({[1-(4-methylphenyl)ethyl]amino}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/C20H24N2O2S2/c1-12-8-10-14(11-9-12)13(2)21-20(25)22-18-17(19(23)24-3)15-6-4-5-7-16(15)26-18/h8-11,13H,4-7H2,1-3H3,(H2,21,22,25)
InChIKey PQSYTNFKMJHHOA-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7766
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/1269056; Labnumber: COL6082; UZI_ID: UZI-007768
Temperature 318 °C