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3-Chloro-5-[(2E,6E)-7-(5,5-dimethyl-4-oxo-tetrahydro-furan-2-yl)-3-methyl-octa-2,6-dienyl]-4-hydroxy-6-methoxy-2-methyl-benzaldehyde
SpectraBase Compound ID IBi6W2JxXkH
InChI InChI=1S/C24H31ClO5/c1-14(8-7-9-15(2)19-12-20(27)24(4,5)30-19)10-11-17-22(28)21(25)16(3)18(13-26)23(17)29-6/h9-10,13,19,28H,7-8,11-12H2,1-6H3/b14-10+,15-9+
InChIKey NWVQECFIIUQJBQ-WEIBIQTGSA-N
Mol Weight 434.96 g/mol
Molecular Formula C24H31ClO5
Exact Mass 434.186002 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 36xslHZkPY
Name 3-Chloro-5-[(2E,6E)-7-(5,5-dimethyl-4-oxo-tetrahydro-furan-2-yl)-3-methyl-octa-2,6-dienyl]-4-hydroxy-6-methoxy-2-methyl-benzaldehyde
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Formula C24H31ClO5
InChI InChI=1S/C24H31ClO5/c1-14(8-7-9-15(2)19-12-20(27)24(4,5)30-19)10-11-17-22(28)21(25)16(3)18(13-26)23(17)29-6/h9-10,13,19,28H,7-8,11-12H2,1-6H3/b14-10+,15-9+
InChIKey NWVQECFIIUQJBQ-WEIBIQTGSA-N
Molecular Weight 434.960 g/mol
SMILES Oc1c(c(c(C=O)c(c1Cl)C)OC)C\C=C\(CC\C=C\(C1OC(C)(C)C(C1)=O)C)C
SPLASH splash10-07cf-9240000000-9fa27e849e85ca00289f
Source of Spectrum AJ-68-2732-29
Synonyms 3-Chloro-4-hydroxy-6-methoxy-2-methyl-5-[(E,E)-3-methyl-7-[tetrahydro-5,5-dimethyl-4-oxofuran-2-yl]octa-2,6-dienyl]benzaldehyde 3-Chloro-4-hydroxy-6-methoxy-2-methyl-5-[(E,E)-3-methyl-7-[tetrahydro-5,5-dimethyl-4-oxofuran-2-yl]octa-2,6-dienyl]benzaldrhyde 3-Chloro-5-[(2E,6E)-7-(5,5-dimethyl-4-oxotetrahydro-2-furanyl)-3-methyl-2,6-octadienyl]-4-hydroxy-6-methoxy-2-methylbenzaldehyde
Wiley ID 773353