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1-(2-chloro-4-nitrophenyl)-4-{[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]carbonyl}piperazine
SpectraBase Compound ID 3Zho9xRBtUi
InChI InChI=1S/C21H18Cl2N4O4/c1-13-19(20(24-31-13)15-4-2-3-5-16(15)22)21(28)26-10-8-25(9-11-26)18-7-6-14(27(29)30)12-17(18)23/h2-7,12H,8-11H2,1H3
InChIKey MVZDVDKOXKQGDM-UHFFFAOYSA-N
Mol Weight 461.31 g/mol
Molecular Formula C21H18Cl2N4O4
Exact Mass 460.07051 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4Hbqb2PcG51
Name 1-(2-chloro-4-nitrophenyl)-4-{[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]carbonyl}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/C21H18Cl2N4O4/c1-13-19(20(24-31-13)15-4-2-3-5-16(15)22)21(28)26-10-8-25(9-11-26)18-7-6-14(27(29)30)12-17(18)23/h2-7,12H,8-11H2,1H3
InChIKey MVZDVDKOXKQGDM-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7529_395
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/8055859; Labnumber: LP-2300362
Temperature 303 °C