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Succinic acid, decyl 4-phenoxybenzyl ester

View entire compound with spectra: 1 NMR

Succinic acid, decyl 4-phenoxybenzyl ester
SpectraBase Compound ID L7nP3vE088q
InChI InChI=1S/C27H36O5/c1-2-3-4-5-6-7-8-12-21-30-26(28)19-20-27(29)31-22-23-15-17-25(18-16-23)32-24-13-10-9-11-14-24/h9-11,13-18H,2-8,12,19-22H2,1H3
InChIKey SRQDMKVPQPWKPU-UHFFFAOYSA-N
Mol Weight 440.6 g/mol
Molecular Formula C27H36O5
Exact Mass 440.256274 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1gcrDr9IXss
Name Succinic acid, decyl 4-phenoxybenzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 440.256274254 u
Formula C27H36O5
InChI InChI=1S/C27H36O5/c1-2-3-4-5-6-7-8-12-21-30-26(28)19-20-27(29)31-22-23-15-17-25(18-16-23)32-24-13-10-9-11-14-24/h9-11,13-18H,2-8,12,19-22H2,1H3
InChIKey SRQDMKVPQPWKPU-UHFFFAOYSA-N
Molecular Weight 440.580 g/mol
SMILES C(CC(OCC1=CC=C(OC2=CC=CC=C2)C=C1)=O)C(OCCCCCCCCCC)=O