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Phthalic acid, 2-fluorobenzyl pentadecyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 2-fluorobenzyl pentadecyl ester
SpectraBase Compound ID GVOT804IQiz
InChI InChI=1S/C30H41FO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-18-23-34-29(32)26-20-15-16-21-27(26)30(33)35-24-25-19-14-17-22-28(25)31/h14-17,19-22H,2-13,18,23-24H2,1H3
InChIKey XCHCYCLKHAPVEB-UHFFFAOYSA-N
Mol Weight 484.7 g/mol
Molecular Formula C30H41FO4
Exact Mass 484.298888 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LkekZ6KHg2S
Name Phthalic acid, 2-fluorobenzyl pentadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 484.298887959 u
Formula C30H41FO4
InChI InChI=1S/C30H41FO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-18-23-34-29(32)26-20-15-16-21-27(26)30(33)35-24-25-19-14-17-22-28(25)31/h14-17,19-22H,2-13,18,23-24H2,1H3
InChIKey XCHCYCLKHAPVEB-UHFFFAOYSA-N
Molecular Weight 484.652 g/mol
SMILES C1=CC=CC(=C1C(OCCCCCCCCCCCCCCC)=O)C(OCC1=CC=CC=C1F)=O