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Methyl 3-((3aS,4S,6S,9aS,9bR)-2,2,6-trimethyl-7-oxooctahydro-4H-4,9a-ethanonaphtho[1,2-d][1,3]dioxol-6-yl)propanoate
SpectraBase Compound ID 2qSOusejK6J
InChI InChI=1S/C20H30O5/c1-18(2)24-16-12-5-9-20(17(16)25-18)10-6-14(21)19(3,13(20)11-12)8-7-15(22)23-4/h12-13,16-17H,5-11H2,1-4H3/t12-,13-,16-,17-,19+,20-/m1/s1
InChIKey CAYIUNKVUDFDHT-FEDQQCEGSA-N
Mol Weight 350.46 g/mol
Molecular Formula C20H30O5
Exact Mass 350.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6TJ0CDzi2Th
Name Methyl 3-((3aS,4S,6S,9aS,9bR)-2,2,6-trimethyl-7-oxooctahydro-4H-4,9a-ethanonaphtho[1,2-d][1,3]dioxol-6-yl)propanoate
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Formula C20H30O5
InChI InChI=1S/C20H30O5/c1-18(2)24-16-12-5-9-20(17(16)25-18)10-6-14(21)19(3,13(20)11-12)8-7-15(22)23-4/h12-13,16-17H,5-11H2,1-4H3/t12-,13-,16-,17-,19+,20-/m1/s1
InChIKey CAYIUNKVUDFDHT-FEDQQCEGSA-N
Literature Reference DOI 10.1002/asia.201403069
Molecular Weight 350.455 g/mol
SMILES C1(CC[C@]23[C@@]4(OC(O[C@@]4([C@@](C[C@@]3([C@]1(C)CCC(OC)=O)[H])(CC2)[H])[H])(C)C)[H])=O
SPLASH splash10-000l-2097000000-a67b10c1aa8c5f9b272d
Source of Spectrum CAJ-10-436-19
Synonyms Methyl 3-((3aS,4S,6RS,9aS,9bR)-2,2,6-trimethyl-7-oxooctahydro-4H-4,9a-ethanonaphtho[1,2-d][1,3]dioxol-6-yl)propanoate
Wiley ID 1785191