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2,4-Pentadienoic acid, 2,4-difluoro-5-phenyl-, ethyl ester, (E,E)-
SpectraBase Compound ID E0DpKyZDaqb
InChI InChI=1S/C13H12F2O2/c1-2-17-13(16)12(15)9-11(14)8-10-6-4-3-5-7-10/h3-9H,2H2,1H3/b11-8+,12-9+
InChIKey JXKLRPACFUEQRA-HZOWPXDZSA-N
Mol Weight 238.23 g/mol
Molecular Formula C13H12F2O2
Exact Mass 238.080536 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BuaIeC6Tn80
Name 2,4-Pentadienoic acid, 2,4-difluoro-5-phenyl-, ethyl ester, (E,E)-
Alternate Name(s) E,e-ethyl 2,4-difluoro-5-phenyl-2,4-pentadienoate Ethyl (2E,4E)-2,4-difluoro-5-phenyl-2,4-pentadienoate
CAS Registry Number 126275-39-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12F2O2
InChI InChI=1S/C13H12F2O2/c1-2-17-13(16)12(15)9-11(14)8-10-6-4-3-5-7-10/h3-9H,2H2,1H3/b11-8+,12-9+
InChIKey JXKLRPACFUEQRA-HZOWPXDZSA-N
Molecular Weight 238.234 g/mol
SMILES C(\C(=C/C(=C\c1ccccc1)F)F)(=O)OCC
SPLASH splash10-02ta-0910000000-85f310dc78698fc621dc
Source of Spectrum J-55-4642-0
Wiley ID 1240422