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5'-Fluoro-2'-(N-propyl)oxy-4-methoxychalcone (isomer 1)

View entire compound with spectra: 1 NMR, and 1 FTIR

5'-Fluoro-2'-(N-propyl)oxy-4-methoxychalcone (isomer 1)
SpectraBase Compound ID H8a52zPHya0
InChI InChI=1S/C19H19FO3/c1-3-12-23-19-11-7-15(20)13-17(19)18(21)10-6-14-4-8-16(22-2)9-5-14/h4-11,13H,3,12H2,1-2H3/b10-6+
InChIKey ZWEWPEPUADVPOJ-UXBLZVDNSA-N
Mol Weight 314.36 g/mol
Molecular Formula C19H19FO3
Exact Mass 314.131823 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ITdclCoqwRr
Name 5'-Fluoro-2'-(N-propyl)oxy-4-methoxychalcone (isomer 1)
Comments Computed using HOSE algorithm
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Exact Mass 314.131822632 u
Formula C19H19FO3
InChI InChI=1S/C19H19FO3/c1-3-12-23-19-11-7-15(20)13-17(19)18(21)10-6-14-4-8-16(22-2)9-5-14/h4-11,13H,3,12H2,1-2H3/b10-6+
InChIKey ZWEWPEPUADVPOJ-UXBLZVDNSA-N
Molecular Weight 314.356 g/mol
SMILES C1(=C(C=CC(=C1)F)OCCC)C(\C=C\C=1C=CC(=CC1)OC)=O