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2-[2-methoxy-4-((E)-{3-methyl-5-oxo-1-[3-(trifluoromethyl)phenyl]-1,5-dihydro-4H-pyrazol-4-ylidene}methyl)phenoxy]acetamide

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2-[2-methoxy-4-((E)-{3-methyl-5-oxo-1-[3-(trifluoromethyl)phenyl]-1,5-dihydro-4H-pyrazol-4-ylidene}methyl)phenoxy]acetamide
SpectraBase Compound ID 9xgCU9RvmAA
InChI InChI=1S/C21H18F3N3O4/c1-12-16(8-13-6-7-17(18(9-13)30-2)31-11-19(25)28)20(29)27(26-12)15-5-3-4-14(10-15)21(22,23)24/h3-10H,11H2,1-2H3,(H2,25,28)/b16-8+
InChIKey BWYBMSVIHCAEJU-LZYBPNLTSA-N
Mol Weight 433.39 g/mol
Molecular Formula C21H18F3N3O4
Exact Mass 433.124941 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 31hE5sdCJYS
Name 2-[2-methoxy-4-((E)-{3-methyl-5-oxo-1-[3-(trifluoromethyl)phenyl]-1,5-dihydro-4H-pyrazol-4-ylidene}methyl)phenoxy]acetamide
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/C21H18F3N3O4/c1-12-16(8-13-6-7-17(18(9-13)30-2)31-11-19(25)28)20(29)27(26-12)15-5-3-4-14(10-15)21(22,23)24/h3-10H,11H2,1-2H3,(H2,25,28)/b16-8+
InChIKey BWYBMSVIHCAEJU-LZYBPNLTSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_5045
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/8074904; Labnumber: BMW-100110A; UZI_ID: UZI-005047
Synonyms 2-[2-methoxy-4-({3-methyl-5-oxo-1-[3-(trifluoromethyl)phenyl]-1,5-dihydro-4H-pyrazol-4-ylidene}methyl)phenoxy]acetamide
Temperature 308 °C