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3-Oxo-15.alpha.,16.alpha.-epoxy-ent-kaurane
SpectraBase Compound ID 7gdF3G0g7X3
InChI InChI=1S/C20H30O2/c1-17(2)13-7-10-20-11-12(19(4)16(20)22-19)5-6-14(20)18(13,3)9-8-15(17)21/h12-14,16H,5-11H2,1-4H3/t12-,13?,14+,16+,18-,19+,20-/m1/s1
InChIKey SVKMTDSTFGJBCS-YUNVWWBISA-N
Mol Weight 302.46 g/mol
Molecular Formula C20H30O2
Exact Mass 302.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Viujl2XOdZ
Name 3-Oxo-15.alpha.,16.alpha.-epoxy-ent-kaurane
Alternate Name(s) (1R,9S,10S,13R,14S,16R)-5,5,9,14-tetramethyl-15-oxapentacyclo[11.3.1.0(1,10).0(4,9).0(14,16)]heptadecan-6-one
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Formula C20H30O2
InChI InChI=1S/C20H30O2/c1-17(2)13-7-10-20-11-12(19(4)16(20)22-19)5-6-14(20)18(13,3)9-8-15(17)21/h12-14,16H,5-11H2,1-4H3/t12-,13?,14+,16+,18-,19+,20-/m1/s1
InChIKey SVKMTDSTFGJBCS-YUNVWWBISA-N
Molecular Weight 302.458 g/mol
SMILES [C@]12([C@@]([C@@]3(CC[C@]4([C@@]5(CCC(C(C5CC[C@]24C3)(C)C)=O)C)[H])[H])(C)O1)[H]
SPLASH splash10-0673-0090000000-ce9de725e5fc0d69e13e
Source of Spectrum F-52-13780-30
Wiley ID 799575