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4,2-Cresotic acid, 6-methoxy-, methyl ester, 3,5-dichloro-4,6-dimethoxy-o-toluate
SpectraBase Compound ID 6Ey2eT7U7np
InChI InChI=1S/C20H20Cl2O7/c1-9-7-11(8-12(25-3)13(9)19(23)28-6)29-20(24)14-10(2)15(21)18(27-5)16(22)17(14)26-4/h7-8H,1-6H3
InChIKey HWHNWWWFYHMWEI-UHFFFAOYSA-N
Mol Weight 443.28 g/mol
Molecular Formula C20H20Cl2O7
Exact Mass 442.058608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CfihvdvMvwX
Name 4,2-Cresotic acid, 6-methoxy-, methyl ester, 3,5-dichloro-4,6-dimethoxy-o-toluate
CAS Registry Number 5859-23-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20Cl2O7
InChI InChI=1S/C20H20Cl2O7/c1-9-7-11(8-12(25-3)13(9)19(23)28-6)29-20(24)14-10(2)15(21)18(27-5)16(22)17(14)26-4/h7-8H,1-6H3
InChIKey HWHNWWWFYHMWEI-UHFFFAOYSA-N
Molecular Weight 443.279 g/mol
SMILES Cc1cc(cc(c1C(=O)OC)OC)OC(c1c(C)c(c(c(c1OC)Cl)OC)Cl)=O
SPLASH splash10-0002-0090000000-92e9c01a2598a317d752
Source of Spectrum SD-1981-0-0
Synonyms 3-Methoxy-4-(methoxycarbonyl)-5-methylphenyl 3,5-dichloro-2,4-dimethoxy-6-methylbenzoate (3-methoxy-4-methoxycarbonyl-5-methyl-phenyl) 3,5-bis(chloranyl)-2,4-dimethoxy-6-methyl-benzoate 3,5-Dichloro-2,4-dimethoxy-6-methyl-benzoic acid (4-carbomethoxy-3-methoxy-5-methyl-phenyl) ester 3,5-Dichloro-2,4-dimethoxy-6-methylbenzoic acid (3-methoxy-4-methoxycarbonyl-5-methylphenyl) ester (3-methoxy-4-methoxycarbonyl-5-methylphenyl) 3,5-dichloro-2,4-dimethoxy-6-methylbenzoate
Wiley ID 1385210