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N-{3-[(4-benzyl-1-piperazinyl)carbonyl]-5,6-dihydro-4H-cyclopenta[b]thien-2-yl}-4-methylbenzamide
SpectraBase Compound ID D4GjBF2EFPk
InChI InChI=1S/C27H29N3O2S/c1-19-10-12-21(13-11-19)25(31)28-26-24(22-8-5-9-23(22)33-26)27(32)30-16-14-29(15-17-30)18-20-6-3-2-4-7-20/h2-4,6-7,10-13H,5,8-9,14-18H2,1H3,(H,28,31)
InChIKey CJMAMLQZXFUDCE-UHFFFAOYSA-N
Mol Weight 459.61 g/mol
Molecular Formula C27H29N3O2S
Exact Mass 459.198048 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HxokCSuCWVu
Name N-{3-[(4-benzyl-1-piperazinyl)carbonyl]-5,6-dihydro-4H-cyclopenta[b]thien-2-yl}-4-methylbenzamide
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/C27H29N3O2S/c1-19-10-12-21(13-11-19)25(31)28-26-24(22-8-5-9-23(22)33-26)27(32)30-16-14-29(15-17-30)18-20-6-3-2-4-7-20/h2-4,6-7,10-13H,5,8-9,14-18H2,1H3,(H,28,31)
InChIKey CJMAMLQZXFUDCE-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_704
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: ZI/8149540; Labnumber: DEC-1400406
Temperature 297 °C