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Benzoic acid, 3,5-dichloro-2-hydroxy-4-methoxy-6-methyl-
SpectraBase Compound ID 7y9QUc472aP
InChI InChI=1S/C9H8Cl2O4/c1-3-4(9(13)14)7(12)6(11)8(15-2)5(3)10/h12H,1-2H3,(H,13,14)
InChIKey CJOJOBYTWJMPOQ-UHFFFAOYSA-N
Mol Weight 251.06 g/mol
Molecular Formula C9H8Cl2O4
Exact Mass 249.979964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BYR8junAljW
Name Benzoic acid, 3,5-dichloro-2-hydroxy-4-methoxy-6-methyl-
CAS Registry Number 31913-66-3
Comments Less than 3 mono-isotopic peaks
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Formula C9H8Cl2O4
InChI InChI=1S/C9H8Cl2O4/c1-3-4(9(13)14)7(12)6(11)8(15-2)5(3)10/h12H,1-2H3,(H,13,14)
InChIKey CJOJOBYTWJMPOQ-UHFFFAOYSA-N
Molecular Weight 251.065 g/mol
SMILES Oc1c(C(=O)O)c(c(c(c1Cl)OC)Cl)C
SPLASH splash10-001i-0090000000-af3cd6791b93c0e282fc
Source of Spectrum B-43-1756-23
Synonyms p-Anisic acid, 3,5-dichloro-2-hydroxy-6-methyl- 3,5-Dichloro-2-hydroxy-4-methoxy-6-methylbenzoic acid 3,5-Dichloroeverninic acid
Wiley ID 1252605