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Phenyl 1,4-bis(3-ethoxyphenyl)-2-naphthoate

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Phenyl 1,4-bis(3-ethoxyphenyl)-2-naphthoate
SpectraBase Compound ID DPFsvRRNsMJ
InChI InChI=1S/C33H28O4/c1-3-35-26-16-10-12-23(20-26)30-22-31(33(34)37-25-14-6-5-7-15-25)32(29-19-9-8-18-28(29)30)24-13-11-17-27(21-24)36-4-2/h5-22H,3-4H2,1-2H3
InChIKey CFFJJNPEOFWAHF-UHFFFAOYSA-N
Mol Weight 488.6 g/mol
Molecular Formula C33H28O4
Exact Mass 488.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1JRSx7IcLsq
Name Phenyl 1,4-bis(3-ethoxyphenyl)-2-naphthoate
Comments Computed using HOSE algorithm
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Exact Mass 488.198759378 u
Formula C33H28O4
InChI InChI=1S/C33H28O4/c1-3-35-26-16-10-12-23(20-26)30-22-31(33(34)37-25-14-6-5-7-15-25)32(29-19-9-8-18-28(29)30)24-13-11-17-27(21-24)36-4-2/h5-22H,3-4H2,1-2H3
InChIKey CFFJJNPEOFWAHF-UHFFFAOYSA-N
Molecular Weight 488.583 g/mol
SMILES C=1(C(=C2C=CC=CC2=C(C1)C=1C=C(OCC)C=CC1)C=1C=C(OCC)C=CC1)C(OC=1C=CC=CC1)=O