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Succinic acid, isohexyl 4-phenoxybenzyl ester

View entire compound with spectra: 1 NMR

Succinic acid, isohexyl 4-phenoxybenzyl ester
SpectraBase Compound ID Fm2XNwFGEh4
InChI InChI=1S/C23H28O5/c1-18(2)7-6-16-26-22(24)14-15-23(25)27-17-19-10-12-21(13-11-19)28-20-8-4-3-5-9-20/h3-5,8-13,18H,6-7,14-17H2,1-2H3
InChIKey DPBNZFZIQVWBCC-UHFFFAOYSA-N
Mol Weight 384.47 g/mol
Molecular Formula C23H28O5
Exact Mass 384.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K5fnzuRuiDA
Name Succinic acid, isohexyl 4-phenoxybenzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 384.193673997 u
Formula C23H28O5
InChI InChI=1S/C23H28O5/c1-18(2)7-6-16-26-22(24)14-15-23(25)27-17-19-10-12-21(13-11-19)28-20-8-4-3-5-9-20/h3-5,8-13,18H,6-7,14-17H2,1-2H3
InChIKey DPBNZFZIQVWBCC-UHFFFAOYSA-N
Molecular Weight 384.472 g/mol
SMILES C(CC(OCC1=CC=C(OC2=CC=CC=C2)C=C1)=O)C(OCCCC(C)C)=O