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Phthalic acid, 3,4-difluorobenzyl decyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 3,4-difluorobenzyl decyl ester
SpectraBase Compound ID I9gwfz2MwLY
InChI InChI=1S/C25H30F2O4/c1-2-3-4-5-6-7-8-11-16-30-24(28)20-12-9-10-13-21(20)25(29)31-18-19-14-15-22(26)23(27)17-19/h9-10,12-15,17H,2-8,11,16,18H2,1H3
InChIKey RSESCFVUMNGJAH-UHFFFAOYSA-N
Mol Weight 432.51 g/mol
Molecular Formula C25H30F2O4
Exact Mass 432.211216 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EFzxldMF5RV
Name Phthalic acid, 3,4-difluorobenzyl decyl ester
Comments Computed using HOSE algorithm
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Exact Mass 432.211215768 u
Formula C25H30F2O4
InChI InChI=1S/C25H30F2O4/c1-2-3-4-5-6-7-8-11-16-30-24(28)20-12-9-10-13-21(20)25(29)31-18-19-14-15-22(26)23(27)17-19/h9-10,12-15,17H,2-8,11,16,18H2,1H3
InChIKey RSESCFVUMNGJAH-UHFFFAOYSA-N
Molecular Weight 432.508 g/mol
SMILES C1=CC=CC(=C1C(OCCCCCCCCCC)=O)C(OCC1=CC=C(C(=C1)F)F)=O