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1-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-{1-[(2,2,2-trifluoroethoxy)methyl]-1H-pyrazol-4-yl}-1H-pyrazole-3-carboxamide

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1-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-{1-[(2,2,2-trifluoroethoxy)methyl]-1H-pyrazol-4-yl}-1H-pyrazole-3-carboxamide
SpectraBase Compound ID j6Hp2k8pyG
InChI InChI=1S/C16H17F3N8O4/c1-10-14(27(29)30)11(2)26(22-10)8-24-4-3-13(23-24)15(28)21-12-5-20-25(6-12)9-31-7-16(17,18)19/h3-6H,7-9H2,1-2H3,(H,21,28)
InChIKey BMELHZKQJWZPQY-UHFFFAOYSA-N
Mol Weight 442.36 g/mol
Molecular Formula C16H17F3N8O4
Exact Mass 442.132486 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1zhRSHx7r4P
Name 1-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-{1-[(2,2,2-trifluoroethoxy)methyl]-1H-pyrazol-4-yl}-1H-pyrazole-3-carboxamide
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/C16H17F3N8O4/c1-10-14(27(29)30)11(2)26(22-10)8-24-4-3-13(23-24)15(28)21-12-5-20-25(6-12)9-31-7-16(17,18)19/h3-6H,7-9H2,1-2H3,(H,21,28)
InChIKey BMELHZKQJWZPQY-UHFFFAOYSA-N
NMR Offset 17.9102
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_30087
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: 1648159; SBI_ID: SBI-030091
Temperature 303 °C