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N-benzyl-2-{[(4-bromophenyl)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide
SpectraBase Compound ID DXRajIH1IWF
InChI InChI=1S/C23H21BrN2O2S/c24-17-11-9-15(10-12-17)13-20(27)26-23-21(18-7-4-8-19(18)29-23)22(28)25-14-16-5-2-1-3-6-16/h1-3,5-6,9-12H,4,7-8,13-14H2,(H,25,28)(H,26,27)
InChIKey FIQUJEYABMPASV-UHFFFAOYSA-N
Mol Weight 469.4 g/mol
Molecular Formula C23H21BrN2O2S
Exact Mass 468.050712 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CfpMjBRdSgV
Name N-benzyl-2-{[(4-bromophenyl)acetyl]amino}-5,6-dihydro-4H-cyclopenta[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/C23H21BrN2O2S/c24-17-11-9-15(10-12-17)13-20(27)26-23-21(18-7-4-8-19(18)29-23)22(28)25-14-16-5-2-1-3-6-16/h1-3,5-6,9-12H,4,7-8,13-14H2,(H,25,28)(H,26,27)
InChIKey FIQUJEYABMPASV-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7777
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/1268322; Labnumber: COL6098; UZI_ID: UZI-007779
Temperature 318 °C