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3,5-bis(difluoromethyl)-1-{3-[(2,2,3,3-tetrafluoropropoxy)methyl]benzoyl}-4,5-dihydro-1H-pyrazol-5-ol
SpectraBase Compound ID 6i1VrcXCBZ7
InChI InChI=1S/C16H14F8N2O3/c17-11(18)10-5-16(28,14(21)22)26(25-10)12(27)9-3-1-2-8(4-9)6-29-7-15(23,24)13(19)20/h1-4,11,13-14,28H,5-7H2
InChIKey LBFIQKSXKXZWBE-UHFFFAOYSA-N
Mol Weight 434.29 g/mol
Molecular Formula C16H14F8N2O3
Exact Mass 434.087668 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EGCmMq5aTpx
Name 3,5-bis(difluoromethyl)-1-{3-[(2,2,3,3-tetrafluoropropoxy)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/C16H14F8N2O3/c17-11(18)10-5-16(28,14(21)22)26(25-10)12(27)9-3-1-2-8(4-9)6-29-7-15(23,24)13(19)20/h1-4,11,13-14,28H,5-7H2
InChIKey LBFIQKSXKXZWBE-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_18442
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/1024452; Labnumber: TYD0310; UZI_ID: UZI-018449
Temperature 308 °C