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

View entire compound with spectra: 2 MS (GC)

Propanoic acid, 3-(2,5-difluorophenyl)-, butyl ester
SpectraBase Compound ID IE3CC7DSTKT
InChI InChI=1S/C13H16F2O2/c1-2-3-8-17-13(16)7-4-10-9-11(14)5-6-12(10)15/h5-6,9H,2-4,7-8H2,1H3
InChIKey UIHKAMKXWWUDHU-UHFFFAOYSA-N
Mol Weight 242.27 g/mol
Molecular Formula C13H16F2O2
Exact Mass 242.111836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FF7DIfu9I5t
Name Propanoic acid, 3-(2,5-difluorophenyl)-, butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16F2O2
InChI InChI=1S/C13H16F2O2/c1-2-3-8-17-13(16)7-4-10-9-11(14)5-6-12(10)15/h5-6,9H,2-4,7-8H2,1H3
InChIKey UIHKAMKXWWUDHU-UHFFFAOYSA-N
Molecular Weight 242.266 g/mol
SMILES C(=O)(CCc1c(ccc(c1)F)F)OCCCC
SPLASH splash10-0006-3900000000-0899072cfd98e0eefd87
Synonyms 3-(2,5-difluorophenyl)propanoic acid butyl ester 3-(2,5-difluorophenyl)propionic acid butyl ester Butyl 3-(2,5-difluorophenyl)propanoate Butyl 3-[2,5-bis(fluoranyl)phenyl]propanoate
Wiley ID 1493929