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2-(2,4-Dichlorophenoxy)propanoic acid, pentafluorobenzyl ester

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

2-(2,4-Dichlorophenoxy)propanoic acid, pentafluorobenzyl ester
SpectraBase Compound ID xS5fiK7UBS
InChI InChI=1S/C16H9Cl2F5O3/c1-6(26-10-3-2-7(17)4-9(10)18)16(24)25-5-8-11(19)13(21)15(23)14(22)12(8)20/h2-4,6H,5H2,1H3
InChIKey PCROGCAYPVHGSU-UHFFFAOYSA-N
Mol Weight 415.14 g/mol
Molecular Formula C16H9Cl2F5O3
Exact Mass 413.98489 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 9ioqPHw9A3O
Name 2-(2,4-Dichlorophenoxy)propanoic acid, pentafluorobenzyl ester
CAS Registry Number 68704-51-8
Copyright Copyright © 1989, 1990-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C16H9Cl2F5O3
InChI InChI=1S/C16H9Cl2F5O3/c1-6(26-10-3-2-7(17)4-9(10)18)16(24)25-5-8-11(19)13(21)15(23)14(22)12(8)20/h2-4,6H,5H2,1H3
InChIKey PCROGCAYPVHGSU-UHFFFAOYSA-N
Instrument Name Bruker IFS 85
Synonyms Propanoic acid, 2-(2,4-dichlorophenoxy)-, (pentafluorophenyl)methyl ester
Technique KBr-Pellet