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Ethyl 4''-chloro-2-hydroxy-5'-oxo-2',3',4',5'-tetrahydro-[1,1':3',1''-terphenyl]-4'-carboxylate
SpectraBase Compound ID KPoMTx5FzP1
InChI InChI=1S/C21H19ClO4/c1-2-26-21(25)20-17(13-7-9-15(22)10-8-13)11-14(12-19(20)24)16-5-3-4-6-18(16)23/h3-10,12,17,20,23H,2,11H2,1H3
InChIKey IMOVFQONGCAWDC-UHFFFAOYSA-N
Mol Weight 370.83 g/mol
Molecular Formula C21H19ClO4
Exact Mass 370.097187 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 12d0OYxeq0
Name Ethyl 4''-chloro-2-hydroxy-5'-oxo-2',3',4',5'-tetrahydro-[1,1':3',1''-terphenyl]-4'-carboxylate
Alternate Name(s) 6-(4-Chlorophenyl)-4-(2-hydroxyphenyl)-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester Ethyl 6-(4-chlorophenyl)-4-(2-hydroxyphenyl)-2-oxocyclohex-3-ene-1-carboxylate Ethyl 6-(4-chlorophenyl)-4-(2-hydroxyphenyl)-2-oxo-cyclohex-3-ene-1-carboxylate Ethyl 6-(4-chlorophenyl)-4-(2-hydroxyphenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate
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Formula C21H19ClO4
InChI InChI=1S/C21H19ClO4/c1-2-26-21(25)20-17(13-7-9-15(22)10-8-13)11-14(12-19(20)24)16-5-3-4-6-18(16)23/h3-10,12,17,20,23H,2,11H2,1H3
InChIKey IMOVFQONGCAWDC-UHFFFAOYSA-N
Molecular Weight 370.832 g/mol
SMILES Oc1c(cccc1)C1=CC(=O)C(C(C1)c1ccc(cc1)Cl)C(=O)OCC
SPLASH splash10-00dj-1495000000-3a22eee24d0b4427a754
Source of Spectrum Y1-45B-468-4c
Wiley ID 1744418