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Succinic acid, 4-biphenyl octyl ester
SpectraBase Compound ID 6jZUDil7GUC
InChI InChI=1S/C24H30O4/c1-2-3-4-5-6-10-19-27-23(25)17-18-24(26)28-22-15-13-21(14-16-22)20-11-8-7-9-12-20/h7-9,11-16H,2-6,10,17-19H2,1H3
InChIKey NGMNEPDWPHKAMO-UHFFFAOYSA-N
Mol Weight 382.5 g/mol
Molecular Formula C24H30O4
Exact Mass 382.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ko7eRSCKrJz
Name Succinic acid, 4-biphenyl octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 382.214409442 u
Formula C24H30O4
InChI InChI=1S/C24H30O4/c1-2-3-4-5-6-10-19-27-23(25)17-18-24(26)28-22-15-13-21(14-16-22)20-11-8-7-9-12-20/h7-9,11-16H,2-6,10,17-19H2,1H3
InChIKey NGMNEPDWPHKAMO-UHFFFAOYSA-N
Molecular Weight 382.500 g/mol
SMILES C(C(OC1=CC=C(C2=CC=CC=C2)C=C1)=O)CC(OCCCCCCCC)=O