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TRIGONOCHINENE_D;METHYL_7-BETA,8-BETA-EPOXY-12-OXO-3,4-SECOCLEISTANTH-9(11),13,15,19(4)-TETRAEN-3-OATE
SpectraBase Compound ID GCHxEarR5Gp
InChI InChI=1S/C21H26O4/c1-7-14-13(4)16(22)11-17-20(5,9-8-19(23)24-6)15(12(2)3)10-18-21(14,17)25-18/h7,11,15,18H,1-2,8-10H2,3-6H3/t15-,18+,20-,21-/m1/s1
InChIKey OLVDZXLYEJAWNY-NSGGIEJNSA-N
Mol Weight 342.44 g/mol
Molecular Formula C21H26O4
Exact Mass 342.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9gz6m3jmtuv
Name 3,8-Dimethyl-4-ethenyl-4a,5-epoxy-6-(1'-methylethenyl)-8-[2'-(methoxycarbonyl)ethy]]-2,5,6,7,8,10-hexahydronaphthalen-2-one
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Formula C21H26O4
InChI InChI=1S/C21H26O4/c1-7-14-13(4)16(22)11-17-20(5,9-8-19(23)24-6)15(12(2)3)10-18-21(14,17)25-18/h7,11,15,18H,1-2,8-10H2,3-6H3/t15-,18+,20-,21-/m1/s1
InChIKey OLVDZXLYEJAWNY-NSGGIEJNSA-N
Molecular Weight 342.435 g/mol
SMILES [C@@]123C([C@@]([C@](C(=C)C)([H])C[C@@]3(O1)[H])(CCC(=O)OC)C)=CC(=O)C(=C2C=C)C
SPLASH splash10-0a4i-0091000000-c9c340824db60341690f
Source of Spectrum G4-71-1417-4
Synonyms Methyl 7.beta.,8.beta.-epoxy-12-oxo-3,4-seco-Leistanth-9(11),13,15,19(4)-tetraen-3-oate Trogonochinene D 3-[(1aS,3R,4R,8aS)-8-ethenyl-4,7-dimethyl-3-(1-methylethenyl)-6-oxo-2,3-dihydro-1aH-naphtho[4,4a-b]oxiren-4-yl]propanoic acid methyl ester Methyl 3-[(1aS,3R,4R,8aS)-8-ethenyl-4,7-dimethyl-6-oxo-3-prop-1-en-2-yl-2,3-dihydro-1aH-naphtho[4,4a-b]oxiren-4-yl]propanoate Methyl 3-[(1aS,3R,4R,8aS)-3-isopropenyl-4,7-dimethyl-6-oxo-8-vinyl-2,3-dihydro-1aH-naphtho[4,4a-b]oxiren-4-yl]propanoate Methyl 3-[(1aS,3R,4R,8aS)-8-ethenyl-4,7-dimethyl-6-oxidanylidene-3-prop-1-en-2-yl-2,3-dihydro-1aH-naphtho[4,4a-b]oxiren-4-yl]propanoate
Wiley ID 1695089