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Succinic acid, 2,5-difluorobenzyl hexadecyl ester

View entire compound with spectra: 1 NMR

Succinic acid, 2,5-difluorobenzyl hexadecyl ester
SpectraBase Compound ID 1X0F1Zb1wzt
InChI InChI=1S/C27H42F2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-32-26(30)18-19-27(31)33-22-23-21-24(28)16-17-25(23)29/h16-17,21H,2-15,18-20,22H2,1H3
InChIKey FUTSQOLHJVLRAA-UHFFFAOYSA-N
Mol Weight 468.6 g/mol
Molecular Formula C27H42F2O4
Exact Mass 468.305116 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BPpF1SJ7Ar4
Name Succinic acid, 2,5-difluorobenzyl hexadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 468.305116154 u
Formula C27H42F2O4
InChI InChI=1S/C27H42F2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-32-26(30)18-19-27(31)33-22-23-21-24(28)16-17-25(23)29/h16-17,21H,2-15,18-20,22H2,1H3
InChIKey FUTSQOLHJVLRAA-UHFFFAOYSA-N
Molecular Weight 468.626 g/mol
SMILES C(CCC(OCC=1C(F)=CC=C(F)C1)=O)(OCCCCCCCCCCCCCCCC)=O