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2-[(2,4-dichlorophenyl)-(2-hydroxy-6-keto-cyclohexen-1-yl)methyl]-3-hydroxy-cyclohex-2-en-1-one
SpectraBase Compound ID JCkWpA0auN5
InChI InChI=1S/C19H18Cl2O4/c20-10-7-8-11(12(21)9-10)17(18-13(22)3-1-4-14(18)23)19-15(24)5-2-6-16(19)25/h7-9,17,22,24H,1-6H2
InChIKey PVMFKFUITPHLEC-UHFFFAOYSA-N
Mol Weight 381.26 g/mol
Molecular Formula C19H18Cl2O4
Exact Mass 380.058214 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5K9ObxVUm1Y
Name 2-[(2,4-dichlorophenyl)-(2-hydroxy-6-keto-cyclohexen-1-yl)methyl]-3-hydroxy-cyclohex-2-en-1-one
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Formula C19H18Cl2O4
InChI InChI=1S/C19H18Cl2O4/c20-10-7-8-11(12(21)9-10)17(18-13(22)3-1-4-14(18)23)19-15(24)5-2-6-16(19)25/h7-9,17,22,24H,1-6H2
InChIKey PVMFKFUITPHLEC-UHFFFAOYSA-N
Molecular Weight 381.255 g/mol
SMILES OC1=C(C(C2=C(CCCC2=O)O)c2c(cc(cc2)Cl)Cl)C(CCC1)=O
SPLASH splash10-001l-9580000000-e586c9bb213d075b6db4
Synonyms 2-[(2,4-dichlorophenyl)-(2-hydroxy-6-oxo-1-cyclohexenyl)methyl]-3-hydroxy-1-cyclohex-2-enone 2-[(2,4-dichlorophenyl)-(2-hydroxy-6-oxo-cyclohexen-1-yl)methyl]-3-hydroxy-cyclohex-2-en-1-one 2-[(2,4-dichlorophenyl)-(2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)methyl]-3-oxidanyl-cyclohex-2-en-1-one
Wiley ID 1451318