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6-tert-pentyl-2-[(3-toluidinocarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
SpectraBase Compound ID 7RbPiJlpzsB
InChI InChI=1S/C22H29N3O2S/c1-5-22(3,4)14-9-10-16-17(12-14)28-20(18(16)19(23)26)25-21(27)24-15-8-6-7-13(2)11-15/h6-8,11,14H,5,9-10,12H2,1-4H3,(H2,23,26)(H2,24,25,27)
InChIKey JFNMMDDUSLIZNL-UHFFFAOYSA-N
Mol Weight 399.55 g/mol
Molecular Formula C22H29N3O2S
Exact Mass 399.198048 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 91LBIg8UVsa
Name 6-tert-pentyl-2-[(3-toluidinocarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
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/C22H29N3O2S/c1-5-22(3,4)14-9-10-16-17(12-14)28-20(18(16)19(23)26)25-21(27)24-15-8-6-7-13(2)11-15/h6-8,11,14H,5,9-10,12H2,1-4H3,(H2,23,26)(H2,24,25,27)
InChIKey JFNMMDDUSLIZNL-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_5872
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/9163334; Labnumber: B_U_ICN/003035; UZI_ID: UZI-005874
Temperature 318 °C