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4-isoquinolinecarbonitrile, 3-(4-benzoyl-1-piperazinyl)-5,6,7,8-tetrahydro-1-phenyl-
SpectraBase Compound ID pkGECaoVz2
InChI InChI=1S/C27H26N4O/c28-19-24-22-13-7-8-14-23(22)25(20-9-3-1-4-10-20)29-26(24)30-15-17-31(18-16-30)27(32)21-11-5-2-6-12-21/h1-6,9-12H,7-8,13-18H2
InChIKey VKFKKVREXJDUAG-UHFFFAOYSA-N
Mol Weight 422.53 g/mol
Molecular Formula C27H26N4O
Exact Mass 422.210661 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DNnN3x2oEZ
Name 4-isoquinolinecarbonitrile, 3-(4-benzoyl-1-piperazinyl)-5,6,7,8-tetrahydro-1-phenyl-
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/C27H26N4O/c28-19-24-22-13-7-8-14-23(22)25(20-9-3-1-4-10-20)29-26(24)30-15-17-31(18-16-30)27(32)21-11-5-2-6-12-21/h1-6,9-12H,7-8,13-18H2
InChIKey VKFKKVREXJDUAG-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_3518
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: NMR/11278493