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Phthalic acid, isohexyl 2-naphthyl ester
SpectraBase Compound ID AEf5F3LgIyZ
InChI InChI=1S/C24H24O4/c1-17(2)8-7-15-27-23(25)21-11-5-6-12-22(21)24(26)28-20-14-13-18-9-3-4-10-19(18)16-20/h3-6,9-14,16-17H,7-8,15H2,1-2H3
InChIKey LNWWJPKPFSGGBD-UHFFFAOYSA-N
Mol Weight 376.45 g/mol
Molecular Formula C24H24O4
Exact Mass 376.167459 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FDhfJvtxSCh
Name Phthalic acid, isohexyl 2-naphthyl ester
Comments Computed using HOSE algorithm
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Exact Mass 376.167459249 u
Formula C24H24O4
InChI InChI=1S/C24H24O4/c1-17(2)8-7-15-27-23(25)21-11-5-6-12-22(21)24(26)28-20-14-13-18-9-3-4-10-19(18)16-20/h3-6,9-14,16-17H,7-8,15H2,1-2H3
InChIKey LNWWJPKPFSGGBD-UHFFFAOYSA-N
Molecular Weight 376.452 g/mol
SMILES CC(C)CCCOC(C1=CC=CC=C1C(OC1=CC=C2C(=C1)C=CC=C2)=O)=O