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USNEOIDONE-E
SpectraBase Compound ID C5cGcH4EZG9
InChI InChI=1S/C28H38O5/c1-19(9-8-13-28(6)25(31)12-14-27(4,5)33-28)15-23(29)16-20(2)10-11-22-18-24(30)17-21(3)26(22)32-7/h10,12,14-15,17-18,30H,8-9,11,13,16H2,1-7H3/b19-15+,20-10+
InChIKey MUZMJSXAAGKLOK-VRGWLGSASA-N
Mol Weight 454.6 g/mol
Molecular Formula C28H38O5
Exact Mass 454.271924 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FtzSxaZfaCF
Name 2-[(4E,8E)-10-(2-methoxy-3-methyl-5-oxidanyl-phenyl)-4,8-dimethyl-6-oxidanylidene-deca-4,8-dienyl]-2,6,6-trimethyl-pyran-3-one
Alternate Name(s) 2-[(4E,8E)-10-(5-hydroxy-2-methoxy-3-methyl-phenyl)-4,8-dimethyl-6-oxo-deca-4,8-dienyl]-2,6,6-trimethyl-pyran-3-one 2-[(4E,8E)-10-(5-hydroxy-2-methoxy-3-methyl-phenyl)-6-keto-4,8-dimethyl-deca-4,8-dienyl]-2,6,6-trimethyl-pyran-3-one 2-[(4E,8E)-10-(5-hydroxy-2-methoxy-3-methylphenyl)-4,8-dimethyl-6-oxodeca-4,8-dienyl]-2,6,6-trimethyl-3-pyranone
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Formula C28H38O5
InChI InChI=1S/C28H38O5/c1-19(9-8-13-28(6)25(31)12-14-27(4,5)33-28)15-23(29)16-20(2)10-11-22-18-24(30)17-21(3)26(22)32-7/h10,12,14-15,17-18,30H,8-9,11,13,16H2,1-7H3/b19-15+,20-10+
InChIKey MUZMJSXAAGKLOK-VRGWLGSASA-N
Molecular Weight 454.607 g/mol
SMILES Oc1cc(c(c(C\C=C\(CC(\C=C\(CCCC2(OC(C=CC2=O)(C)C)C)C)=O)C)c1)OC)C
SPLASH splash10-0006-0910100000-0331a7f2c8cd642b390a
Source of Spectrum K1-2004-1921-1
Wiley ID 1560760