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Propanoic acid, 3-(2,5-difluorophenyl)-, heptyl ester
SpectraBase Compound ID 1K9h20ICXZO
InChI InChI=1S/C16H22F2O2/c1-2-3-4-5-6-11-20-16(19)10-7-13-12-14(17)8-9-15(13)18/h8-9,12H,2-7,10-11H2,1H3
InChIKey BHMQEBPVQCMEAN-UHFFFAOYSA-N
Mol Weight 284.35 g/mol
Molecular Formula C16H22F2O2
Exact Mass 284.158786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HBtoqHp20g9
Name Propanoic acid, 3-(2,5-difluorophenyl)-, heptyl ester
Alternate Name(s) 3-(2,5-difluorophenyl)propanoic acid heptyl ester 3-(2,5-difluorophenyl)propionic acid heptyl ester Heptyl 3-(2,5-difluorophenyl)propanoate Heptyl 3-[2,5-bis(fluoranyl)phenyl]propanoate
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Formula C16H22F2O2
InChI InChI=1S/C16H22F2O2/c1-2-3-4-5-6-11-20-16(19)10-7-13-12-14(17)8-9-15(13)18/h8-9,12H,2-7,10-11H2,1H3
InChIKey BHMQEBPVQCMEAN-UHFFFAOYSA-N
Molecular Weight 284.347 g/mol
SMILES C(=O)(CCc1c(ccc(c1)F)F)OCCCCCCC
SPLASH splash10-052f-7900000000-8c4a2e0644a9cde5749d
Wiley ID 1493926