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Terephthalic acid, 4-fluoro-2-methoxyphenyl nonyl ester

View entire compound with spectra: 1 NMR

Terephthalic acid, 4-fluoro-2-methoxyphenyl nonyl ester
SpectraBase Compound ID 1vjme4GFq38
InChI InChI=1S/C24H29FO5/c1-3-4-5-6-7-8-9-16-29-23(26)18-10-12-19(13-11-18)24(27)30-21-15-14-20(25)17-22(21)28-2/h10-15,17H,3-9,16H2,1-2H3
InChIKey FVYPNVIPROLZJW-UHFFFAOYSA-N
Mol Weight 416.49 g/mol
Molecular Formula C24H29FO5
Exact Mass 416.199902 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 175IqkecjYt
Name Terephthalic acid, 4-fluoro-2-methoxyphenyl nonyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 416.199902192 u
Formula C24H29FO5
InChI InChI=1S/C24H29FO5/c1-3-4-5-6-7-8-9-16-29-23(26)18-10-12-19(13-11-18)24(27)30-21-15-14-20(25)17-22(21)28-2/h10-15,17H,3-9,16H2,1-2H3
InChIKey FVYPNVIPROLZJW-UHFFFAOYSA-N
Molecular Weight 416.489 g/mol
SMILES C1(=CC=C(C=C1)C(OCCCCCCCCC)=O)C(OC1=C(C=C(C=C1)F)OC)=O