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methyl 1-{[4-chloro-3,5-bis(4-fluorophenyl)-1H-pyrazol-1-yl]methyl}-1H-pyrazole-3-carboxylate
SpectraBase Compound ID G78M8iWYGQR
InChI InChI=1S/C21H15ClF2N4O2/c1-30-21(29)17-10-11-27(25-17)12-28-20(14-4-8-16(24)9-5-14)18(22)19(26-28)13-2-6-15(23)7-3-13/h2-11H,12H2,1H3
InChIKey QNIAHIRLIKDWRT-UHFFFAOYSA-N
Mol Weight 428.83 g/mol
Molecular Formula C21H15ClF2N4O2
Exact Mass 428.08516 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID yLWoSkqvPV
Name methyl 1-{[4-chloro-3,5-bis(4-fluorophenyl)-1H-pyrazol-1-yl]methyl}-1H-pyrazole-3-carboxylate
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/C21H15ClF2N4O2/c1-30-21(29)17-10-11-27(25-17)12-28-20(14-4-8-16(24)9-5-14)18(22)19(26-28)13-2-6-15(23)7-3-13/h2-11H,12H2,1H3
InChIKey QNIAHIRLIKDWRT-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_30244
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: 1713861; SBI_ID: SBI-030248
Temperature 318 °C