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3H-pyrazol-3-one, 2-(4-fluorophenyl)-2,4-dihydro-5-propyl-4-[[[(tetrahydro-2-furanyl)methyl]amino]methylene]-, (4E)-
SpectraBase Compound ID 651KsxmR1I7
InChI InChI=1S/C18H22FN3O2/c1-2-4-17-16(12-20-11-15-5-3-10-24-15)18(23)22(21-17)14-8-6-13(19)7-9-14/h6-9,12,15,20H,2-5,10-11H2,1H3/b16-12+
InChIKey CHPYWDOGDKGDCA-FOWTUZBSSA-N
Mol Weight 331.39 g/mol
Molecular Formula C18H22FN3O2
Exact Mass 331.169605 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3SazDmAUkK
Name 2-(4-Fluoro-phenyl)-5-propyl-4-[[(tetrahydro-furan-2-ylmethyl)-amino]-methylene]-2,4-dihydro-pyrazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22FN3O2
InChI InChI=1S/C18H22FN3O2/c1-2-4-17-16(12-20-11-15-5-3-10-24-15)18(23)22(21-17)14-8-6-13(19)7-9-14/h6-9,12,15,20H,2-5,10-11H2,1H3/b16-12+
InChIKey CHPYWDOGDKGDCA-FOWTUZBSSA-N
Molecular Weight 331.391 g/mol
SMILES N(\C=C\1C(N(N=C1CCC)c1ccc(cc1)F)=O)CC1OCCC1
SPLASH splash10-001i-5394000000-e9cd7aa08923e1698ad4
Synonyms (4E)-2-(4-fluorophenyl)-4-[(2-oxolanylmethylamino)methylidene]-5-propyl-3-pyrazolone (4E)-2-(4-fluorophenyl)-4-[(oxolan-2-ylmethylamino)methylidene]-5-propyl-pyrazol-3-one (4E)-2-(4-fluorophenyl)-5-propyl-4-[(tetrahydrofuran-2-ylmethylamino)methylene]pyrazol-3-one (4E)-2-(4-fluorophenyl)-5-propyl-4-[(tetrahydrofurfurylamino)methylene]-2-pyrazolin-3-one
Wiley ID 1462560