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HYIQPOJSOSXRKS-GQCTYLIASA-N

View entire compound with spectra: 2 NMR, and 1 MS (GC)

HYIQPOJSOSXRKS-GQCTYLIASA-N
SpectraBase Compound ID 1wDE4MsWPtW
InChI InChI=1S/C15H18O3/c1-10(2)5-4-6-11(3)13-8-7-12(9-16)14(17)15(13)18/h4-9,11,17-18H,1-3H3/b6-4+
InChIKey HYIQPOJSOSXRKS-GQCTYLIASA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IHeOnQoVR8i
Name 2,3-Dihydroxy-4-[(3E)-6-methylhepta-3,5-dien-2-yl]benzaldehyde
Alternate Name(s) 4-[(2E)-1,5-dimethylhexa-2,4-dienyl]-2,3-dihydroxy-benzaldehyde 4-[(3E)-6-methylhepta-3,5-dien-2-yl]-2,3-bis(oxidanyl)benzaldehyde Parahigginol D
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Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-10(2)5-4-6-11(3)13-8-7-12(9-16)14(17)15(13)18/h4-9,11,17-18H,1-3H3/b6-4+
InChIKey HYIQPOJSOSXRKS-GQCTYLIASA-N
Molecular Weight 246.306 g/mol
SMILES Oc1c(ccc(c1O)C(\C=C\C=C(C)C)C)C=O
SPLASH splash10-002g-9530000000-b96461fa6a9e9cac5b6e
Source of Spectrum G4-62-575-4
Wiley ID 1607823