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Micheliolide
SpectraBase Compound ID 5LOjBYrOOhU
InChI InChI=1S/C15H20O3/c1-8-4-5-11-9(2)14(16)18-13(11)12-10(8)6-7-15(12,3)17/h11-13,17H,2,4-7H2,1,3H3/t11-,12-,13+,15+/m0/s1
InChIKey RDJAFOWISVMOJY-RMRHIDDWSA-N
Mol Weight 248.32 g/mol
Molecular Formula C15H20O3
Exact Mass 248.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8IiFNqgCFdC
Name Micheliolide
Alternate Name(s) 9-Hydroxy-6,9-dimethyl-3-methylidene-4,5,7,8,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-2-one 6,9-Dimethyl-3-methylidene-9-oxidanyl-4,5,7,8,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-2-one
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Formula C15H20O3
InChI InChI=1S/C15H20O3/c1-8-4-5-11-9(2)14(16)18-13(11)12-10(8)6-7-15(12,3)17/h11-13,17H,2,4-7H2,1,3H3/t11-,12-,13+,15+/m0/s1
InChIKey RDJAFOWISVMOJY-RMRHIDDWSA-N
Molecular Weight 248.322 g/mol
SMILES O[C@]1([C@@]2([C@@]3(OC(=O)C([C@@]3(CCC(=C2CC1)C)[H])=C)[H])[H])C
SPLASH splash10-0006-7940000000-32ac5fdf5fdb0d561742
Source of Spectrum X2-56-97-5
Wiley ID 1604689