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CSRJYVIKHJFLSA-UHFFFAOYSA-N
SpectraBase Compound ID Jdrc4Utd0jH
InChI InChI=1S/C17H14Cl2O7/c1-6-4-8(5-9(20)10(6)16(23)25-3)26-17(24)11-7(2)12(18)15(22)13(19)14(11)21/h4-5,20-22H,1-3H3
InChIKey CSRJYVIKHJFLSA-UHFFFAOYSA-N
Mol Weight 401.2 g/mol
Molecular Formula C17H14Cl2O7
Exact Mass 400.011658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2faRY3CoLx3
Name Benzoic acid, 3,5-dichloro-2,4-dihydroxy-6-methyl-, 3-hydroxy-4-(methoxycarbonyl)-5-methylphenyl ester
CAS Registry Number 4382-39-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14Cl2O7
InChI InChI=1S/C17H14Cl2O7/c1-6-4-8(5-9(20)10(6)16(23)25-3)26-17(24)11-7(2)12(18)15(22)13(19)14(11)21/h4-5,20-22H,1-3H3
InChIKey CSRJYVIKHJFLSA-UHFFFAOYSA-N
Molecular Weight 401.198 g/mol
SMILES Oc1c(c(cc(OC(c2c(c(c(c(c2O)Cl)O)Cl)C)=O)c1)C)C(OC)=O
SPLASH splash10-0g4i-7920000000-59471202734f79fef06b
Source of Spectrum SD-1981-0-0
Synonyms 3-Hydroxy-4-(methoxycarbonyl)-5-methylphenyl 3,5-dichloro-2,4-dihydroxy-6-methylbenzoate (4-methoxycarbonyl-3-methyl-5-oxidanyl-phenyl) 3,5-bis(chloranyl)-2-methyl-4,6-bis(oxidanyl)benzoate .beta.-Resorcylic acid, 3,5-dichloro-6-methyl-, 4-ester with methyl 6-methyl-.beta.-resorcyl alcohol 3,5-Dichloro-2,4-dihydroxy-6-methyl-benzoic acid (4-carbomethoxy-3-hydroxy-5-methyl-phenyl) ester 3,5-Dichloro-2,4-dihydroxy-6-methylbenzoic acid (3-hydroxy-4-methoxycarbonyl-5-methylphenyl) ester Methyl 3,5-dichlorolecanorate Tumidulin Turnidulin (3-hydroxy-4-methoxycarbonyl-5-methylphenyl) 3,5-dichloro-2,4-dihydroxy-6-methylbenzoate
Wiley ID 1369226