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3-(Benzo[d][1,3]dioxol-5-yl)-5-(4-fluorophenyl)-4,5-dihydro-1H-pyrazole-1-carbaldehyde
SpectraBase Compound ID 11CHBmkqu44
InChI InChI=1S/C17H13FN2O3/c18-13-4-1-11(2-5-13)15-8-14(19-20(15)9-21)12-3-6-16-17(7-12)23-10-22-16/h1-7,9,15H,8,10H2
InChIKey NSIIXRLCLGAKTL-UHFFFAOYSA-N
Mol Weight 312.3 g/mol
Molecular Formula C17H13FN2O3
Exact Mass 312.09102 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2BVvOPpqgvH
Name 3-(Benzo[d][1,3]dioxol-5-yl)-5-(4-fluorophenyl)-4,5-dihydro-1H-pyrazole-1-carbaldehyde
Alternate Name(s) 5-(1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)-3,4-dihydropyrazole-2-carboxaldehyde 5-(1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)-3,4-dihydropyrazole-2-carbaldehyde
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Formula C17H13FN2O3
InChI InChI=1S/C17H13FN2O3/c18-13-4-1-11(2-5-13)15-8-14(19-20(15)9-21)12-3-6-16-17(7-12)23-10-22-16/h1-7,9,15H,8,10H2
InChIKey NSIIXRLCLGAKTL-UHFFFAOYSA-N
Molecular Weight 312.300 g/mol
SMILES c1c(cc2c(c1)OCO2)C1=NN(C(C1)c1ccc(cc1)F)C=O
SPLASH splash10-03di-0229000000-d73de21a1c147bf3cfa5
Source of Spectrum APC-345-281-5c
Wiley ID 1769336