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Glutaric acid, pentadecyl pentafluorobenzyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, pentadecyl pentafluorobenzyl ester
SpectraBase Compound ID GMQp2Nwidyq
InChI InChI=1S/C27H39F5O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-35-21(33)16-15-17-22(34)36-19-20-23(28)25(30)27(32)26(31)24(20)29/h2-19H2,1H3
InChIKey MOYCVPSQUDOPOT-UHFFFAOYSA-N
Mol Weight 522.6 g/mol
Molecular Formula C27H39F5O4
Exact Mass 522.276851 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EiBo9Idxp3h
Name Glutaric acid, pentadecyl pentafluorobenzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 522.276850547 u
Formula C27H39F5O4
InChI InChI=1S/C27H39F5O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-35-21(33)16-15-17-22(34)36-19-20-23(28)25(30)27(32)26(31)24(20)29/h2-19H2,1H3
InChIKey MOYCVPSQUDOPOT-UHFFFAOYSA-N
Molecular Weight 522.597 g/mol
SMILES CCCCCCCCCCCCCCCOC(CCCC(OCC1=C(C(=C(C(=C1F)F)F)F)F)=O)=O