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Glutaric acid, 1-(pentafluorophenyl)ethyl tetradecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 1-(pentafluorophenyl)ethyl tetradecyl ester
SpectraBase Compound ID H7soUVulScp
InChI InChI=1S/C27H39F5O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-18-35-20(33)16-15-17-21(34)36-19(2)22-23(28)25(30)27(32)26(31)24(22)29/h19H,3-18H2,1-2H3
InChIKey NJYZWLSJRPZAOO-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 Iiiw8YQqThm
Name Glutaric acid, 1-(pentafluorophenyl)ethyl tetradecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 522.276850547 u
Formula C27H39F5O4
InChI InChI=1S/C27H39F5O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-18-35-20(33)16-15-17-21(34)36-19(2)22-23(28)25(30)27(32)26(31)24(22)29/h19H,3-18H2,1-2H3
InChIKey NJYZWLSJRPZAOO-UHFFFAOYSA-N
Molecular Weight 522.597 g/mol
SMILES C(OC(C)C1=C(C(=C(C(=C1F)F)F)F)F)(=O)CCCC(OCCCCCCCCCCCCCC)=O