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3-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-{1-[(2,2,2-trifluoroethoxy)methyl]-1H-pyrazol-4-yl}benzamide
SpectraBase Compound ID 3MEpobDC2yA
InChI InChI=1S/C19H19ClF3N5O2/c1-12-17(20)13(2)28(26-12)8-14-4-3-5-15(6-14)18(29)25-16-7-24-27(9-16)11-30-10-19(21,22)23/h3-7,9H,8,10-11H2,1-2H3,(H,25,29)
InChIKey ZWNAMTSVVPWMHH-UHFFFAOYSA-N
Mol Weight 441.84 g/mol
Molecular Formula C19H19ClF3N5O2
Exact Mass 441.117937 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AI1rrmrZOW8
Name 3-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-{1-[(2,2,2-trifluoroethoxy)methyl]-1H-pyrazol-4-yl}benzamide
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/C19H19ClF3N5O2/c1-12-17(20)13(2)28(26-12)8-14-4-3-5-15(6-14)18(29)25-16-7-24-27(9-16)11-30-10-19(21,22)23/h3-7,9H,8,10-11H2,1-2H3,(H,25,29)
InChIKey ZWNAMTSVVPWMHH-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_30069
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: 1624812; SBI_ID: SBI-030073
Temperature 308 °C