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3-[3-carbomethoxy-5-(2-chloroethyl)-2-hydroxy-4,6-dimethyl-phenyl]-5-(2-chloroethyl)-2-hydroxy-4,6-dimethyl-benzoic acid methyl ester
SpectraBase Compound ID A55iV9DHkNB
InChI InChI=1S/C24H28Cl2O6/c1-11-15(7-9-25)13(3)19(23(29)31-5)21(27)17(11)18-12(2)16(8-10-26)14(4)20(22(18)28)24(30)32-6/h27-28H,7-10H2,1-6H3
InChIKey KYMSJBBBCHAUPW-UHFFFAOYSA-N
Mol Weight 483.39 g/mol
Molecular Formula C24H28Cl2O6
Exact Mass 482.126294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GGIO4qiDgrh
Name 3-[3-carbomethoxy-5-(2-chloroethyl)-2-hydroxy-4,6-dimethyl-phenyl]-5-(2-chloroethyl)-2-hydroxy-4,6-dimethyl-benzoic acid methyl ester
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Formula C24H28Cl2O6
InChI InChI=1S/C24H28Cl2O6/c1-11-15(7-9-25)13(3)19(23(29)31-5)21(27)17(11)18-12(2)16(8-10-26)14(4)20(22(18)28)24(30)32-6/h27-28H,7-10H2,1-6H3
InChIKey KYMSJBBBCHAUPW-UHFFFAOYSA-N
Molecular Weight 483.388 g/mol
SMILES Oc1c(-c2c(c(c(c(c2C)CCCl)C)C(=O)OC)O)c(c(c(c1C(=O)OC)C)CCCl)C
SPLASH splash10-0uni-1000900000-e4293127bd71e3328fbd
Source of Spectrum KC-61-4618-2
Synonyms 5-(2-Chloroethyl)-3-[5-(2-chloroethyl)-2-hydroxy-3-methoxycarbonyl-4,6-dimethylphenyl]-2-hydroxy-4,6-dimethylbenzoic acid methyl ester Methyl 3-(2-chloroethyl)-5-[3-(2-chloroethyl)-5-methoxycarbonyl-2,4-dimethyl-6-oxidanyl-phenyl]-2,4-dimethyl-6-oxidanyl-benzoate Methyl 5-(2-chloroethyl)-3-[5-(2-chloroethyl)-2-hydroxy-3-methoxycarbonyl-4,6-dimethyl-phenyl]-2-hydroxy-4,6-dimethyl-benzoate
Wiley ID 1629054