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Propanoic acid, 3-(2,5-difluorophenyl)-, heptyl ester

View entire compound with spectra: 2 MS (GC)

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 CXMGeyt5b1d
Name PROPIONIC ACID, 3-(2,5-DIFLUOROPHENYL)-, HEPTYL ESTER
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
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 284.1582
SMILES c1c(CCC(OCCCCCCC)=O)c(F)ccc1F
SPLASH splash10-052f-7900000000-c97a7538f4e707e641f0
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany