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Glutaric acid, 4-chloro-3-methylphenyl 4-biphenyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 4-chloro-3-methylphenyl 4-biphenyl ester
SpectraBase Compound ID HOBg6eKmQ4f
InChI InChI=1S/C24H21ClO4/c1-17-16-21(14-15-22(17)25)29-24(27)9-5-8-23(26)28-20-12-10-19(11-13-20)18-6-3-2-4-7-18/h2-4,6-7,10-16H,5,8-9H2,1H3
InChIKey JQQJDIMEXZMJAT-UHFFFAOYSA-N
Mol Weight 408.88 g/mol
Molecular Formula C24H21ClO4
Exact Mass 408.112837 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FyqHUL9prRj
Name Glutaric acid, 4-chloro-3-methylphenyl 4-biphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 408.112836852 u
Formula C24H21ClO4
InChI InChI=1S/C24H21ClO4/c1-17-16-21(14-15-22(17)25)29-24(27)9-5-8-23(26)28-20-12-10-19(11-13-20)18-6-3-2-4-7-18/h2-4,6-7,10-16H,5,8-9H2,1H3
InChIKey JQQJDIMEXZMJAT-UHFFFAOYSA-N
Molecular Weight 408.881 g/mol
SMILES C1=CC=C(C=C1)C1=CC=C(OC(=O)CCCC(OC2=CC(C)=C(C=C2)Cl)=O)C=C1