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4-(3-chloro-2-hydroxy-6-methoxy-benzoyl)oxy-6-hydroxy-3-methoxy-2-methyl-benzoic acid ethyl ester
SpectraBase Compound ID AFzhnqAtENJ
InChI InChI=1S/C19H19ClO8/c1-5-27-18(23)14-9(2)17(26-4)13(8-11(14)21)28-19(24)15-12(25-3)7-6-10(20)16(15)22/h6-8,21-22H,5H2,1-4H3
InChIKey ACKXROKYMCHEJL-UHFFFAOYSA-N
Mol Weight 410.81 g/mol
Molecular Formula C19H19ClO8
Exact Mass 410.076845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GSbtp7x8acg
Name 4-(3-chloro-2-hydroxy-6-methoxy-benzoyl)oxy-6-hydroxy-3-methoxy-2-methyl-benzoic acid ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C19H19ClO8
InChI InChI=1S/C19H19ClO8/c1-5-27-18(23)14-9(2)17(26-4)13(8-11(14)21)28-19(24)15-12(25-3)7-6-10(20)16(15)22/h6-8,21-22H,5H2,1-4H3
InChIKey ACKXROKYMCHEJL-UHFFFAOYSA-N
Molecular Weight 410.806 g/mol
SMILES Oc1cc(OC(c2c(c(ccc2OC)Cl)O)=O)c(c(c1C(=O)OCC)C)OC
SPLASH splash10-001i-0900000000-983787d9baac767ec2d1
Source of Spectrum B-46-95-0
Synonyms 4-[(3-chloro-2-hydroxy-6-methoxyphenyl)-oxomethoxy]-6-hydroxy-3-methoxy-2-methylbenzoic acid ethyl ester ethyl 4-(3-chloranyl-6-methoxy-2-oxidanyl-phenyl)carbonyloxy-3-methoxy-2-methyl-6-oxidanyl-benzoate ethyl 4-(3-chloro-2-hydroxy-6-methoxybenzoyl)oxy-6-hydroxy-3-methoxy-2-methylbenzoate
Wiley ID 1373529