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((3,8-Dehydro-4,8,12-Trinortaxan-2,9-dione)-10.alpha.,13.alpha.-diyl)diacetate
SpectraBase Compound ID 298vDQ0OIp2
InChI InChI=1S/C21H28O6/c1-11(22)26-13-9-16-18(24)14-7-5-6-8-15(14)19(25)20(27-12(2)23)17(10-13)21(16,3)4/h13,16-17,20H,5-10H2,1-4H3/t13-,16-,17+,20-/m0/s1
InChIKey STJCAJIYIONFPV-NYYTWLDWSA-N
Mol Weight 376.45 g/mol
Molecular Formula C21H28O6
Exact Mass 376.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4eNAdPQCp1O
Name ((3,8-Dehydro-4,8,12-Trinortaxan-2,9-dione)-10.alpha.,13.alpha.-diyl)diacetate
Alternate Name(s) (1R,10S,11S,13R)-10-(acetyloxy)-15,15-dimethyl-2,9-dioxotricyclo[9.3.1.0(3,8)]pentadec-3(8)-en-13-yl acetate
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Formula C21H28O6
InChI InChI=1S/C21H28O6/c1-11(22)26-13-9-16-18(24)14-7-5-6-8-15(14)19(25)20(27-12(2)23)17(10-13)21(16,3)4/h13,16-17,20H,5-10H2,1-4H3/t13-,16-,17+,20-/m0/s1
InChIKey STJCAJIYIONFPV-NYYTWLDWSA-N
Molecular Weight 376.449 g/mol
SMILES C12=C(C([C@@](OC(=O)C)([C@@]3(C([C@](C2=O)(C[C@@](C3)(OC(=O)C)[H])[H])(C)C)[H])[H])=O)CCCC1
SPLASH splash10-00e9-0095000000-01a432c3f7e3edba32ea
Source of Spectrum F-48-6961-16
Wiley ID 1357775