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2-{4-[(4-chlorophenyl)(phenyl)methyl]-1-piperazinyl}-1-(2-methyl-1H-indol-3-yl)ethanone
SpectraBase Compound ID GeGgca8fDIl
InChI InChI=1S/C28H28ClN3O/c1-20-27(24-9-5-6-10-25(24)30-20)26(33)19-31-15-17-32(18-16-31)28(21-7-3-2-4-8-21)22-11-13-23(29)14-12-22/h2-14,28,30H,15-19H2,1H3
InChIKey MSYHDGMHUCEXDM-UHFFFAOYSA-N
Mol Weight 458.01 g/mol
Molecular Formula C28H28ClN3O
Exact Mass 457.19209 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DUQNs08eSQ2
Name 2-{4-[(4-chlorophenyl)(phenyl)methyl]-1-piperazinyl}-1-(2-methyl-1H-indol-3-yl)ethanone
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/C28H28ClN3O/c1-20-27(24-9-5-6-10-25(24)30-20)26(33)19-31-15-17-32(18-16-31)28(21-7-3-2-4-8-21)22-11-13-23(29)14-12-22/h2-14,28,30H,15-19H2,1H3
InChIKey MSYHDGMHUCEXDM-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_21853
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: D55836; Labnumber: Simak-01740; SBI_ID: SBI-021857
Temperature 315 °C