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4.beta.-Hydroxy-5.alpha.,8.beta.(H)-guaia-1(10)Z,7(11)Z-dien-12,8-olide
SpectraBase Compound ID A7yfDYdoAv8
InChI InChI=1S/C15H20O3/c1-8-6-13-11(9(2)14(16)18-13)7-12-10(8)4-5-15(12,3)17/h12-13,17H,4-7H2,1-3H3/t12-,13+,15+/m1/s1
InChIKey MDVGVCGUQWWZSM-IPYPFGDCSA-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 BNfBRT6isjo
Name 4.beta.-Hydroxy-5.alpha.,8.beta.(H)-guaia-1(10)Z,7(11)Z-dien-12,8-olide
Alternate Name(s) Chlospicate C (4aR,5S,9aS)-5-hydroxy-3,5,8-trimethyl-4a,5,6,7,9,9a-hexahydroazuleno[6,5-b]furan-2(4H)-one (3aS,8S,8aR)-1,5,8-trimethyl-8-oxidanyl-3a,4,6,7,8a,9-hexahydroazuleno[6,5-b]furan-2-one
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Formula C15H20O3
InChI InChI=1S/C15H20O3/c1-8-6-13-11(9(2)14(16)18-13)7-12-10(8)4-5-15(12,3)17/h12-13,17H,4-7H2,1-3H3/t12-,13+,15+/m1/s1
InChIKey MDVGVCGUQWWZSM-IPYPFGDCSA-N
Literature Reference DOI 10.1002/cjoc.201200455
Molecular Weight 248.322 g/mol
SMILES O[C@]1(CCC2=C(C[C@]3(C(=C(C)C(=O)O3)C[C@@]12[H])[H])C)C
SPLASH splash10-001i-0790000000-85a3332b8cf506009863
Source of Spectrum CJC-30-1248-3
Wiley ID 1772717