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3-[(1R,3Z,7E)-1-hydroxy-4-(hydroxymethyl)-8-methyl-10-(2,6,6-trimethyl-1-cyclohexenyl)deca-3,7-dienyl]-2H-furan-5-one
SpectraBase Compound ID ibWc9RLeWc
InChI InChI=1S/C25H38O4/c1-18(10-12-22-19(2)8-6-14-25(22,3)4)7-5-9-20(16-26)11-13-23(27)21-15-24(28)29-17-21/h7,11,15,23,26-27H,5-6,8-10,12-14,16-17H2,1-4H3/b18-7+,20-11-/t23-/m1/s1
InChIKey APZLDGIERUEODP-JTASSXHHSA-N
Mol Weight 402.6 g/mol
Molecular Formula C25H38O4
Exact Mass 402.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6uuJV1Urwfk
Name 3-[(1R,3Z,7E)-1-hydroxy-4-(hydroxymethyl)-8-methyl-10-(2,6,6-trimethyl-1-cyclohexenyl)deca-3,7-dienyl]-2H-furan-5-one
Alternate Name(s) 3-[(1R,3Z,7E)-1-hydroxy-4-(hydroxymethyl)-8-methyl-10-(2,6,6-trimethylcyclohexen-1-yl)deca-3,7-dienyl]-2H-furan-5-one 3-[(1R,3Z,7E)-1-hydroxy-8-methyl-4-methylol-10-(2,6,6-trimethylcyclohexen-1-yl)deca-3,7-dienyl]-2H-furan-5-one 3-[(1R,3Z,7E)-4-(hydroxymethyl)-8-methyl-1-oxidanyl-10-(2,6,6-trimethylcyclohexen-1-yl)deca-3,7-dienyl]-2H-furan-5-one
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Formula C25H38O4
InChI InChI=1S/C25H38O4/c1-18(10-12-22-19(2)8-6-14-25(22,3)4)7-5-9-20(16-26)11-13-23(27)21-15-24(28)29-17-21/h7,11,15,23,26-27H,5-6,8-10,12-14,16-17H2,1-4H3/b18-7+,20-11-/t23-/m1/s1
InChIKey APZLDGIERUEODP-JTASSXHHSA-N
Molecular Weight 402.575 g/mol
SMILES OC\C(=C/C[C@](C1=CC(=O)OC1)(O)[H])CC\C=C\(CCC1=C(CCCC1(C)C)C)C
SPLASH splash10-000i-0900000000-13a00164f7e7c43c97a4
Source of Spectrum J-57-3506-2
Wiley ID 1370576