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Fumaric acid, pentafluorobenzyl naphth-2-ylmethyl ester

View entire compound with spectra: 1 NMR

Fumaric acid, pentafluorobenzyl naphth-2-ylmethyl ester
SpectraBase Compound ID L7VYv9goBse
InChI InChI=1S/C22H13F5O4/c23-18-15(19(24)21(26)22(27)20(18)25)11-31-17(29)8-7-16(28)30-10-12-5-6-13-3-1-2-4-14(13)9-12/h1-9H,10-11H2/b8-7+
InChIKey GMUUXZYTMUABJY-BQYQJAHWSA-N
Mol Weight 436.33 g/mol
Molecular Formula C22H13F5O4
Exact Mass 436.0734 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CBF0bdF0fGw
Name Fumaric acid, pentafluorobenzyl naphth-2-ylmethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 436.073399710 u
Formula C22H13F5O4
InChI InChI=1S/C22H13F5O4/c23-18-15(19(24)21(26)22(27)20(18)25)11-31-17(29)8-7-16(28)30-10-12-5-6-13-3-1-2-4-14(13)9-12/h1-9H,10-11H2/b8-7+
InChIKey GMUUXZYTMUABJY-BQYQJAHWSA-N
Molecular Weight 436.334 g/mol
SMILES C(\C=C\C(OCC1=CC2=C(C=CC=C2)C=C1)=O)(OCC1=C(C(=C(C(=C1F)F)F)F)F)=O