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(1S,3E,7S,10R)-7-ethoxy-10-isopropenyl-3-methyl-15-oxabicyclo[11.2.1]hexadeca-3,13(16)-diene-5,8,11,14-diquinone
SpectraBase Compound ID JnuMpeWBLwQ
InChI InChI=1S/C21H26O6/c1-5-26-20-10-15(22)6-13(4)7-16-8-14(21(25)27-16)9-18(23)17(12(2)3)11-19(20)24/h6,8,16-17,20H,2,5,7,9-11H2,1,3-4H3/b13-6+/t16-,17+,20-/m0/s1
InChIKey ALTRNXWGUQFXSC-UNNYLJGKSA-N
Mol Weight 374.43 g/mol
Molecular Formula C21H26O6
Exact Mass 374.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8SakenIaTB1
Name (1S,3E,7S,10R)-7-ethoxy-10-isopropenyl-3-methyl-15-oxabicyclo[11.2.1]hexadeca-3,13(16)-diene-5,8,11,14-diquinone
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Formula C21H26O6
InChI InChI=1S/C21H26O6/c1-5-26-20-10-15(22)6-13(4)7-16-8-14(21(25)27-16)9-18(23)17(12(2)3)11-19(20)24/h6,8,16-17,20H,2,5,7,9-11H2,1,3-4H3/b13-6+/t16-,17+,20-/m0/s1
InChIKey ALTRNXWGUQFXSC-UNNYLJGKSA-N
Molecular Weight 374.433 g/mol
SMILES C1=2C(O[C@](C2)(C\C(=C\C(=O)C[C@@](C(C[C@@](C(C1)=O)(C(=C)C)[H])=O)(OCC)[H])C)[H])=O
SPLASH splash10-05uv-9411000000-9063c65f45426abf0126
Source of Spectrum G4-61-404-2
Synonyms (1S,3E,7S,10R)-7-ethoxy-10-isopropenyl-3-methyl-15-oxabicyclo[11.2.1]hexadeca-3,13(16)-diene-5,8,11,14-tetrone (1S,3E,7S,10R)-7-ethoxy-3-methyl-10-(1-methylethenyl)-15-oxabicyclo[11.2.1]hexadeca-3,13(16)-diene-5,8,11,14-tetrone (1S,3E,7S,10R)-7-ethoxy-3-methyl-10-prop-1-en-2-yl-15-oxabicyclo[11.2.1]hexadeca-3,13(16)-diene-5,8,11,14-tetrone
Wiley ID 1607133