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1-Methoxy-4-(3,3,3-trifluoro-1,1-diphenylprop-1-en-2-yl)benzene
SpectraBase Compound ID LHhn5ji13V5
InChI InChI=1S/C22H17F3O/c1-26-19-14-12-18(13-15-19)21(22(23,24)25)20(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-15H,1H3
InChIKey ICESZTUCDAIVDL-UHFFFAOYSA-N
Mol Weight 354.37 g/mol
Molecular Formula C22H17F3O
Exact Mass 354.12315 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1qy2FptmYH6
Name 1-Methoxy-4-(3,3,3-trifluoro-1,1-diphenylprop-1-en-2-yl)benzene
Comments Computed using HOSE algorithm
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Exact Mass 354.123149655 u
Formula C22H17F3O
InChI InChI=1S/C22H17F3O/c1-26-19-14-12-18(13-15-19)21(22(23,24)25)20(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-15H,1H3
InChIKey ICESZTUCDAIVDL-UHFFFAOYSA-N
Molecular Weight 354.372 g/mol
SMILES C(C(F)(F)F)(=C(C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=C(C=C1)OC