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Succinic acid, 2-methylphenyl pentafluorobenzyl ester

View entire compound with spectra: 1 NMR

Succinic acid, 2-methylphenyl pentafluorobenzyl ester
SpectraBase Compound ID DQ4axtIHjL5
InChI InChI=1S/C18H13F5O4/c1-9-4-2-3-5-11(9)27-13(25)7-6-12(24)26-8-10-14(19)16(21)18(23)17(22)15(10)20/h2-5H,6-8H2,1H3
InChIKey JSHPWMWQVGZDRX-UHFFFAOYSA-N
Mol Weight 388.29 g/mol
Molecular Formula C18H13F5O4
Exact Mass 388.0734 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8DDoS0eWc3y
Name Succinic acid, 2-methylphenyl pentafluorobenzyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 388.073399710 u
Formula C18H13F5O4
InChI InChI=1S/C18H13F5O4/c1-9-4-2-3-5-11(9)27-13(25)7-6-12(24)26-8-10-14(19)16(21)18(23)17(22)15(10)20/h2-5H,6-8H2,1H3
InChIKey JSHPWMWQVGZDRX-UHFFFAOYSA-N
Molecular Weight 388.290 g/mol
SMILES C1(=C(C(=C(C(=C1F)F)COC(CCC(OC1=CC=CC=C1C)=O)=O)F)F)F