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Succinic acid, naphth-2-ylmethyl 2,3-dimethylphenyl ester
SpectraBase Compound ID 3mv6MgTlmjQ
InChI InChI=1S/C23H22O4/c1-16-6-5-9-21(17(16)2)27-23(25)13-12-22(24)26-15-18-10-11-19-7-3-4-8-20(19)14-18/h3-11,14H,12-13,15H2,1-2H3
InChIKey MQIFXZXDEVMGAR-UHFFFAOYSA-N
Mol Weight 362.43 g/mol
Molecular Formula C23H22O4
Exact Mass 362.151809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6LFLcBmGBts
Name Succinic acid, naphth-2-ylmethyl 2,3-dimethylphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 362.151809184 u
Formula C23H22O4
InChI InChI=1S/C23H22O4/c1-16-6-5-9-21(17(16)2)27-23(25)13-12-22(24)26-15-18-10-11-19-7-3-4-8-20(19)14-18/h3-11,14H,12-13,15H2,1-2H3
InChIKey MQIFXZXDEVMGAR-UHFFFAOYSA-N
Molecular Weight 362.425 g/mol
SMILES C(CC(OCC1=CC2=C(C=CC=C2)C=C1)=O)C(OC1=C(C(C)=CC=C1)C)=O