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1-([1,1'-biphenyl]-4-ylcarbonyl)-4-[4-(methylsulfanyl)benzyl]piperazine
SpectraBase Compound ID 6JtG9MAhAyK
InChI InChI=1S/C25H26N2OS/c1-29-24-13-7-20(8-14-24)19-26-15-17-27(18-16-26)25(28)23-11-9-22(10-12-23)21-5-3-2-4-6-21/h2-14H,15-19H2,1H3
InChIKey NQMUFIYYOJXIJQ-UHFFFAOYSA-N
Mol Weight 402.56 g/mol
Molecular Formula C25H26N2OS
Exact Mass 402.176585 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3j1Cp2js1i0
Name 1-([1,1'-biphenyl]-4-ylcarbonyl)-4-[4-(methylsulfanyl)benzyl]piperazine
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/C25H26N2OS/c1-29-24-13-7-20(8-14-24)19-26-15-17-27(18-16-26)25(28)23-11-9-22(10-12-23)21-5-3-2-4-6-21/h2-14H,15-19H2,1H3
InChIKey NQMUFIYYOJXIJQ-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13921
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/9319295; UBI_ID: UBI-013924
Synonyms 4-{[4-([1,1'-biphenyl]-4-ylcarbonyl)-1-piperazinyl]methyl}phenyl methyl sulfide
Temperature 308 °C