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Succinic acid, heptyl 4-phenoxybenzyl ester

View entire compound with spectra: 1 NMR

Succinic acid, heptyl 4-phenoxybenzyl ester
SpectraBase Compound ID L4i2AbbPQLX
InChI InChI=1S/C24H30O5/c1-2-3-4-5-9-18-27-23(25)16-17-24(26)28-19-20-12-14-22(15-13-20)29-21-10-7-6-8-11-21/h6-8,10-15H,2-5,9,16-19H2,1H3
InChIKey UTVMUXNJZHFZSX-UHFFFAOYSA-N
Mol Weight 398.5 g/mol
Molecular Formula C24H30O5
Exact Mass 398.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IYnUqltsa25
Name Succinic acid, heptyl 4-phenoxybenzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 398.209324061 u
Formula C24H30O5
InChI InChI=1S/C24H30O5/c1-2-3-4-5-9-18-27-23(25)16-17-24(26)28-19-20-12-14-22(15-13-20)29-21-10-7-6-8-11-21/h6-8,10-15H,2-5,9,16-19H2,1H3
InChIKey UTVMUXNJZHFZSX-UHFFFAOYSA-N
Molecular Weight 398.499 g/mol
SMILES C(CC(OCC1=CC=C(OC2=CC=CC=C2)C=C1)=O)C(OCCCCCCC)=O