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3,5-bis(difluoromethyl)-1-{4-[(4-nitro-1H-pyrazol-1-yl)methyl]benzoyl}-4,5-dihydro-1H-pyrazol-5-ol
SpectraBase Compound ID BcOFYULLlSt
InChI InChI=1S/C16H13F4N5O4/c17-13(18)12-5-16(27,15(19)20)24(22-12)14(26)10-3-1-9(2-4-10)7-23-8-11(6-21-23)25(28)29/h1-4,6,8,13,15,27H,5,7H2
InChIKey QPXUQJFJSDWVIW-UHFFFAOYSA-N
Mol Weight 415.3 g/mol
Molecular Formula C16H13F4N5O4
Exact Mass 415.090367 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6HGj6G0tgHt
Name 3,5-bis(difluoromethyl)-1-{4-[(4-nitro-1H-pyrazol-1-yl)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/C16H13F4N5O4/c17-13(18)12-5-16(27,15(19)20)24(22-12)14(26)10-3-1-9(2-4-10)7-23-8-11(6-21-23)25(28)29/h1-4,6,8,13,15,27H,5,7H2
InChIKey QPXUQJFJSDWVIW-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_18508
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/1028523; Labnumber: TYD0386; UZI_ID: UZI-018515
Temperature 308 °C