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1-{[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carbonyl}-4-(4-methoxyphenyl)piperazine
SpectraBase Compound ID DqBaMYOvG9N
InChI InChI=1S/C22H21ClFN3O3/c1-14-19(21(25-30-14)20-17(23)4-3-5-18(20)24)22(28)27-12-10-26(11-13-27)15-6-8-16(29-2)9-7-15/h3-9H,10-13H2,1-2H3
InChIKey ZMWFQCBVBWXBSU-UHFFFAOYSA-N
Mol Weight 429.88 g/mol
Molecular Formula C22H21ClFN3O3
Exact Mass 429.125547 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 97KQS76rnS2
Name 1-{[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carbonyl}-4-(4-methoxyphenyl)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/C22H21ClFN3O3/c1-14-19(21(25-30-14)20-17(23)4-3-5-18(20)24)22(28)27-12-10-26(11-13-27)15-6-8-16(29-2)9-7-15/h3-9H,10-13H2,1-2H3
InChIKey ZMWFQCBVBWXBSU-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_15351
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/9315761; Labnumber: NSB-0097773; UZI_ID: UZI-015355
Synonyms 4-(4-{[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carbonyl}-1-piperazinyl)phenyl methyl ether
Temperature 308 °C