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(4E)-3-methyl-4-[3-(trifluoromethyl)benzylidene]-1H-pyridazin-6-one
SpectraBase Compound ID BRoZJX37ccs
InChI InChI=1S/C13H11F3N2O/c1-8-10(7-12(19)18-17-8)5-9-3-2-4-11(6-9)13(14,15)16/h2-6H,7H2,1H3,(H,18,19)/b10-5+
InChIKey NPNXNCLJUSGHHB-BJMVGYQFSA-N
Mol Weight 268.24 g/mol
Molecular Formula C13H11F3N2O
Exact Mass 268.082347 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ARrCjY5TeKq
Name (4E)-3-methyl-4-[3-(trifluoromethyl)benzylidene]-1H-pyridazin-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11F3N2O
InChI InChI=1S/C13H11F3N2O/c1-8-10(7-12(19)18-17-8)5-9-3-2-4-11(6-9)13(14,15)16/h2-6H,7H2,1H3,(H,18,19)/b10-5+
InChIKey NPNXNCLJUSGHHB-BJMVGYQFSA-N
Molecular Weight 268.239 g/mol
SMILES N1C(C\C(C(=N1)C)=C\c1cc(C(F)(F)F)ccc1)=O
SPLASH splash10-014i-0390000000-389fc59a954088fc2336
Source of Spectrum O-26-1083-3
Synonyms (4E)-3-methyl-4-[[3-(trifluoromethyl)phenyl]methylene]-1H-pyridazin-6-one (4E)-3-methyl-4-[[3-(trifluoromethyl)phenyl]methylidene]-1H-pyridazin-6-one
Wiley ID 1271794