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1-(3,5-bis{[4-(2,5-dimethylphenyl)-1-piperazinyl]carbonyl}benzoyl)-4-(2,5-dimethylphenyl)piperazine
SpectraBase Compound ID 717iZWKvdiQ
InChI InChI=1S/C45H54N6O3/c1-31-7-10-34(4)40(25-31)46-13-19-49(20-14-46)43(52)37-28-38(44(53)50-21-15-47(16-22-50)41-26-32(2)8-11-35(41)5)30-39(29-37)45(54)51-23-17-48(18-24-51)42-27-33(3)9-12-36(42)6/h7-12,25-30H,13-24H2,1-6H3
InChIKey XJFSQWZZNVNFPK-UHFFFAOYSA-N
Mol Weight 727.0 g/mol
Molecular Formula C45H54N6O3
Exact Mass 726.42574 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4pXnAu5yakF
Name 1-(3,5-bis{[4-(2,5-dimethylphenyl)-1-piperazinyl]carbonyl}benzoyl)-4-(2,5-dimethylphenyl)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/C45H54N6O3/c1-31-7-10-34(4)40(25-31)46-13-19-49(20-14-46)43(52)37-28-38(44(53)50-21-15-47(16-22-50)41-26-32(2)8-11-35(41)5)30-39(29-37)45(54)51-23-17-48(18-24-51)42-27-33(3)9-12-36(42)6/h7-12,25-30H,13-24H2,1-6H3
InChIKey XJFSQWZZNVNFPK-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_15179
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/9311636; Labnumber: NSB-0096675; UZI_ID: UZI-015183
Temperature 313 °C