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N-benzyl-2-[(4-phenylbutanoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
SpectraBase Compound ID JGlLbiSmPol
InChI InChI=1S/C27H30N2O2S/c30-24(18-10-15-20-11-4-1-5-12-20)29-27-25(22-16-8-3-9-17-23(22)32-27)26(31)28-19-21-13-6-2-7-14-21/h1-2,4-7,11-14H,3,8-10,15-19H2,(H,28,31)(H,29,30)
InChIKey QTBOBWDNXYUDLW-UHFFFAOYSA-N
Mol Weight 446.61 g/mol
Molecular Formula C27H30N2O2S
Exact Mass 446.202799 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 65tqhHBUgD6
Name N-benzyl-2-[(4-phenylbutanoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-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/C27H30N2O2S/c30-24(18-10-15-20-11-4-1-5-12-20)29-27-25(22-16-8-3-9-17-23(22)32-27)26(31)28-19-21-13-6-2-7-14-21/h1-2,4-7,11-14H,3,8-10,15-19H2,(H,28,31)(H,29,30)
InChIKey QTBOBWDNXYUDLW-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7788
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/1268185; Labnumber: COL6118; UZI_ID: UZI-007790
Temperature 318 °C