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Succinic acid, 4-fluorophenethyl hexadecyl ester

View entire compound with spectra: 1 NMR

Succinic acid, 4-fluorophenethyl hexadecyl ester
SpectraBase Compound ID HyV1y2xES5W
InChI InChI=1S/C28H45FO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-23-32-27(30)20-21-28(31)33-24-22-25-16-18-26(29)19-17-25/h16-19H,2-15,20-24H2,1H3
InChIKey JJNLYKGTQJZXJO-UHFFFAOYSA-N
Mol Weight 464.7 g/mol
Molecular Formula C28H45FO4
Exact Mass 464.330188 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Foq3uMQAWzm
Name Succinic acid, 4-fluorophenethyl hexadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 464.330188088 u
Formula C28H45FO4
InChI InChI=1S/C28H45FO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-23-32-27(30)20-21-28(31)33-24-22-25-16-18-26(29)19-17-25/h16-19H,2-15,20-24H2,1H3
InChIKey JJNLYKGTQJZXJO-UHFFFAOYSA-N
Molecular Weight 464.662 g/mol
SMILES C(CCC(OCCC1=CC=C(C=C1)F)=O)(OCCCCCCCCCCCCCCCC)=O