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1-{4-[(4-chloro-1H-pyrazol-1-yl)methyl]benzoyl}-3,5-bis(difluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol
SpectraBase Compound ID BjoG9o6hLb1
InChI InChI=1S/C16H13ClF4N4O2/c17-11-6-22-24(8-11)7-9-1-3-10(4-2-9)14(26)25-16(27,15(20)21)5-12(23-25)13(18)19/h1-4,6,8,13,15,27H,5,7H2
InChIKey RITQYZXTOHSINZ-UHFFFAOYSA-N
Mol Weight 404.75 g/mol
Molecular Formula C16H13ClF4N4O2
Exact Mass 404.066316 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DCZmDCl3vJj
Name 1-{4-[(4-chloro-1H-pyrazol-1-yl)methyl]benzoyl}-3,5-bis(difluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol
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/C16H13ClF4N4O2/c17-11-6-22-24(8-11)7-9-1-3-10(4-2-9)14(26)25-16(27,15(20)21)5-12(23-25)13(18)19/h1-4,6,8,13,15,27H,5,7H2
InChIKey RITQYZXTOHSINZ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9290
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/1024588; Labnumber: ICA0120; UZI_ID: UZI-009292
Temperature 308 °C