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2-[(4-phenylbutanoyl)amino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxamide
SpectraBase Compound ID 20dyJmTSeCC
InChI InChI=1S/C25H34N2O2S/c26-24(29)23-20-16-10-5-3-1-2-4-6-11-17-21(20)30-25(23)27-22(28)18-12-15-19-13-8-7-9-14-19/h7-9,13-14H,1-6,10-12,15-18H2,(H2,26,29)(H,27,28)
InChIKey ASHKVIAICGPFCL-UHFFFAOYSA-N
Mol Weight 426.6 g/mol
Molecular Formula C25H34N2O2S
Exact Mass 426.2341 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6LigoMdgAFK
Name 2-[(4-phenylbutanoyl)amino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[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/C25H34N2O2S/c26-24(29)23-20-16-10-5-3-1-2-4-6-11-17-21(20)30-25(23)27-22(28)18-12-15-19-13-8-7-9-14-19/h7-9,13-14H,1-6,10-12,15-18H2,(H2,26,29)(H,27,28)
InChIKey ASHKVIAICGPFCL-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_1921
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/9387642; Labnumber: AM-AC/0116069; UZI_ID: UZI-001923
Temperature 318 °C