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Glutaric acid, 2-fluorophenyl tetradecyl ester
SpectraBase Compound ID 54nGEcT1CeJ
InChI InChI=1S/C25H39FO4/c1-2-3-4-5-6-7-8-9-10-11-12-15-21-29-24(27)19-16-20-25(28)30-23-18-14-13-17-22(23)26/h13-14,17-18H,2-12,15-16,19-21H2,1H3
InChIKey ZOQMKMKUDGMILF-UHFFFAOYSA-N
Mol Weight 422.6 g/mol
Molecular Formula C25H39FO4
Exact Mass 422.283238 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GNiX4gXlCSX
Name Glutaric acid, 2-fluorophenyl tetradecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 422.283237895 u
Formula C25H39FO4
InChI InChI=1S/C25H39FO4/c1-2-3-4-5-6-7-8-9-10-11-12-15-21-29-24(27)19-16-20-25(28)30-23-18-14-13-17-22(23)26/h13-14,17-18H,2-12,15-16,19-21H2,1H3
InChIKey ZOQMKMKUDGMILF-UHFFFAOYSA-N
Molecular Weight 422.581 g/mol
SMILES CCCCCCCCCCCCCCOC(CCCC(OC1=CC=CC=C1F)=O)=O