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Succinic acid, dodecyl 4-phenoxybenzyl ester

View entire compound with spectra: 1 NMR

Succinic acid, dodecyl 4-phenoxybenzyl ester
SpectraBase Compound ID G7xNjciuCjG
InChI InChI=1S/C29H40O5/c1-2-3-4-5-6-7-8-9-10-14-23-32-28(30)21-22-29(31)33-24-25-17-19-27(20-18-25)34-26-15-12-11-13-16-26/h11-13,15-20H,2-10,14,21-24H2,1H3
InChIKey DZKAZRKASTULFI-UHFFFAOYSA-N
Mol Weight 468.6 g/mol
Molecular Formula C29H40O5
Exact Mass 468.287574 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5iCmpbVjyQA
Name Succinic acid, dodecyl 4-phenoxybenzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 468.287574383 u
Formula C29H40O5
InChI InChI=1S/C29H40O5/c1-2-3-4-5-6-7-8-9-10-14-23-32-28(30)21-22-29(31)33-24-25-17-19-27(20-18-25)34-26-15-12-11-13-16-26/h11-13,15-20H,2-10,14,21-24H2,1H3
InChIKey DZKAZRKASTULFI-UHFFFAOYSA-N
Molecular Weight 468.634 g/mol
SMILES C(CC(OCC1=CC=C(OC2=CC=CC=C2)C=C1)=O)C(OCCCCCCCCCCCC)=O