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7.alpha.-Hydroxy-Frullanolide
SpectraBase Compound ID CASK3bSmA2T
InChI InChI=1S/C15H20O3/c1-9-5-4-6-14(3)7-8-15(17)10(2)13(16)18-12(15)11(9)14/h12,17H,2,4-8H2,1,3H3/t12?,14-,15-/m1/s1
InChIKey XMPDAVDYIOMTLX-JENMUQSASA-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 EOhXVzKZjno
Name 7.alpha.-Hydroxy-Frullanolide
Alternate Name(s) (3aR,5aR)-3a-hydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,8,9b-hexahydrobenzo[g][1]benzofuran-2-one (3aR,5aR)-5a,9-dimethyl-3-methylidene-3a-oxidanyl-4,5,6,7,8,9b-hexahydrobenzo[g][1]benzofuran-2-one
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Formula C15H20O3
InChI InChI=1S/C15H20O3/c1-9-5-4-6-14(3)7-8-15(17)10(2)13(16)18-12(15)11(9)14/h12,17H,2,4-8H2,1,3H3/t12?,14-,15-/m1/s1
InChIKey XMPDAVDYIOMTLX-JENMUQSASA-N
Molecular Weight 248.322 g/mol
SMILES O[C@@]12C(C(OC2C2=C(CCC[C@@]2(CC1)C)C)=O)=C
SPLASH splash10-001i-0190000000-0bd8b49f1161ec7b536a
Source of Spectrum X2-52-133-2
Wiley ID 1603021