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Phthalic acid, 4-chloro-3-methylphenyl 3,5-dimethylphenyl ester

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Phthalic acid, 4-chloro-3-methylphenyl 3,5-dimethylphenyl ester
SpectraBase Compound ID 91G6U8hQnaW
InChI InChI=1S/C23H19ClO4/c1-14-10-15(2)12-18(11-14)28-23(26)20-7-5-4-6-19(20)22(25)27-17-8-9-21(24)16(3)13-17/h4-13H,1-3H3
InChIKey YEZHMRITFJZJLW-UHFFFAOYSA-N
Mol Weight 394.85 g/mol
Molecular Formula C23H19ClO4
Exact Mass 394.097187 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3At73sgg2Wf
Name Phthalic acid, 4-chloro-3-methylphenyl 3,5-dimethylphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 394.097186788 u
Formula C23H19ClO4
InChI InChI=1S/C23H19ClO4/c1-14-10-15(2)12-18(11-14)28-23(26)20-7-5-4-6-19(20)22(25)27-17-8-9-21(24)16(3)13-17/h4-13H,1-3H3
InChIKey YEZHMRITFJZJLW-UHFFFAOYSA-N
Molecular Weight 394.854 g/mol
SMILES C1=C(C(=CC=C1)C(OC1=CC(C)=CC(C)=C1)=O)C(OC1=CC=C(C(=C1)C)Cl)=O