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3,5-bis(difluoromethyl)-1-[2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoyl]-4,5-dihydro-1H-pyrazol-5-ol
SpectraBase Compound ID 1Mp8TaEFa5O
InChI InChI=1S/C12H13F4N5O5/c1-5(19-4-7(21(24)25)9(18-19)26-2)10(22)20-12(23,11(15)16)3-6(17-20)8(13)14/h4-5,8,11,23H,3H2,1-2H3
InChIKey MQSXNVTUFYFYEL-UHFFFAOYSA-N
Mol Weight 383.26 g/mol
Molecular Formula C12H13F4N5O5
Exact Mass 383.085281 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HVnPltEc86u
Name 3,5-bis(difluoromethyl)-1-[2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoyl]-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/C12H13F4N5O5/c1-5(19-4-7(21(24)25)9(18-19)26-2)10(22)20-12(23,11(15)16)3-6(17-20)8(13)14/h4-5,8,11,23H,3H2,1-2H3
InChIKey MQSXNVTUFYFYEL-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9319
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/1026594; Labnumber: ICA0165; UZI_ID: UZI-009321
Temperature 308 °C