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1,4b,5,6,10,10a-Hexahydro-10a.beta.-methoxycarbonyl-4b.beta.,1-dimethyl-3(2H)-phenanthrenone
SpectraBase Compound ID JTiI6BHkwTE
InChI InChI=1S/C18H22O3/c1-12-10-14(19)11-15-17(2)8-5-4-6-13(17)7-9-18(12,15)16(20)21-3/h4,6-7,11-12H,5,8-10H2,1-3H3/t12?,17-,18+/m1/s1
InChIKey LVIBFTICCWVIHJ-ALTJMEPPSA-N
Mol Weight 286.37 g/mol
Molecular Formula C18H22O3
Exact Mass 286.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KlFYphPL6Iy
Name 1,4b,5,6,10,10a-Hexahydro-10a.beta.-methoxycarbonyl-4b.beta.,1-dimethyl-3(2H)-phenanthrenone
Comments Less than 3 mono-isotopic peaks
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Formula C18H22O3
InChI InChI=1S/C18H22O3/c1-12-10-14(19)11-15-17(2)8-5-4-6-13(17)7-9-18(12,15)16(20)21-3/h4,6-7,11-12H,5,8-10H2,1-3H3/t12?,17-,18+/m1/s1
InChIKey LVIBFTICCWVIHJ-ALTJMEPPSA-N
Molecular Weight 286.371 g/mol
SMILES C1=2[C@](C(C)CC(C2)=O)(C(=O)OC)CC=C2[C@]1(CCC=C2)C
SPLASH splash10-004r-0090000000-69ed8af60c925c813841
Source of Spectrum AJ-61-3594-15
Synonyms 1,4b,5,6,10,10a-hexahydro-10a.beta.-methoxycarbonyl-4b.beta.,i-dimethyl-3(2H)-phenanthrenone methyl (4aR,8aS)-4a,8-dimethyl-6-oxo-3,4a,6,7,8,9-hexahydro-8a(4H)-phenanthrenecarboxylate
Wiley ID 1290184