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3,5-bis(difluoromethyl)-1-{4-[(4-isopropylphenoxy)methyl]benzoyl}-4,5-dihydro-1H-pyrazol-5-ol
SpectraBase Compound ID 9Hi96DP2qAI
InChI InChI=1S/C22H22F4N2O3/c1-13(2)15-7-9-17(10-8-15)31-12-14-3-5-16(6-4-14)20(29)28-22(30,21(25)26)11-18(27-28)19(23)24/h3-10,13,19,21,30H,11-12H2,1-2H3
InChIKey CZNSKCQIFSPDNZ-UHFFFAOYSA-N
Mol Weight 438.42 g/mol
Molecular Formula C22H22F4N2O3
Exact Mass 438.156655 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9BVwKrI2JPB
Name 3,5-bis(difluoromethyl)-1-{4-[(4-isopropylphenoxy)methyl]benzoyl}-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/C22H22F4N2O3/c1-13(2)15-7-9-17(10-8-15)31-12-14-3-5-16(6-4-14)20(29)28-22(30,21(25)26)11-18(27-28)19(23)24/h3-10,13,19,21,30H,11-12H2,1-2H3
InChIKey CZNSKCQIFSPDNZ-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9320
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/1026333; Labnumber: ICA0167; UZI_ID: UZI-009322
Temperature 308 °C