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1-{[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carbonyl}-4-(5-chloro-2-methylphenyl)piperazine
SpectraBase Compound ID FJb7igvcuSm
InChI InChI=1S/C22H20Cl2FN3O2/c1-13-6-7-15(23)12-18(13)27-8-10-28(11-9-27)22(29)19-14(2)30-26-21(19)20-16(24)4-3-5-17(20)25/h3-7,12H,8-11H2,1-2H3
InChIKey MVXBIKPLWCGISL-UHFFFAOYSA-N
Mol Weight 448.33 g/mol
Molecular Formula C22H20Cl2FN3O2
Exact Mass 447.09166 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GWxFzl9wbJO
Name 1-{[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carbonyl}-4-(5-chloro-2-methylphenyl)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/C22H20Cl2FN3O2/c1-13-6-7-15(23)12-18(13)27-8-10-28(11-9-27)22(29)19-14(2)30-26-21(19)20-16(24)4-3-5-17(20)25/h3-7,12H,8-11H2,1-2H3
InChIKey MVXBIKPLWCGISL-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_15348
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/9314404; Labnumber: NSB-0097741; UZI_ID: UZI-015352
Temperature 308 °C