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(4E)-4-(1,3-Benzodioxol-5-ylmethylene)-2-(3-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID LH1eDzSAhze
InChI InChI=1S/C18H13FN2O3/c1-11-15(7-12-5-6-16-17(8-12)24-10-23-16)18(22)21(20-11)14-4-2-3-13(19)9-14/h2-9H,10H2,1H3/b15-7+
InChIKey GQOUHSFASJQNOH-VIZOYTHASA-N
Mol Weight 324.31 g/mol
Molecular Formula C18H13FN2O3
Exact Mass 324.09102 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IUYOdukxBwi
Name (4E)-4-(1,3-Benzodioxol-5-ylmethylene)-2-(3-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Alternate Name(s) (4E)-2-(3-fluorophenyl)-5-methyl-4-piperonylidene-2-pyrazolin-3-one (4E)-4-(1,3-benzodioxol-5-ylmethylene)-2-(3-fluorophenyl)-5-methyl-pyrazol-3-one (4E)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(3-fluorophenyl)-5-methyl-3-pyrazolone (4E)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(3-fluorophenyl)-5-methyl-pyrazol-3-one 1-(3-Fluorophenyl)-3-methyl-4-piperonylidene-2-pyrazolin-5-one
CAS Registry Number 330577-69-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13FN2O3
InChI InChI=1S/C18H13FN2O3/c1-11-15(7-12-5-6-16-17(8-12)24-10-23-16)18(22)21(20-11)14-4-2-3-13(19)9-14/h2-9H,10H2,1H3/b15-7+
InChIKey GQOUHSFASJQNOH-VIZOYTHASA-N
Molecular Weight 324.311 g/mol
SMILES C1(\C(C(=NN1c1cc(ccc1)F)C)=C\c1ccc2c(c1)OCO2)=O
SPLASH splash10-00di-9836000000-c6c54f4cfaf3fae204d9
Wiley ID 1467876