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(E)-3-[(5R,6aS,9aR)-5-(2-Benzyloxy-ethyl)-octahydro-dicyclopenta[1,3]dioxin-5-yl]-acrylic acid methyl ester
SpectraBase Compound ID J6Z9zJTrIdY
InChI InChI=1S/C23H30O5/c1-25-21(24)11-14-23(15-16-26-17-18-7-3-2-4-8-18)27-19-9-5-12-22(19)13-6-10-20(22)28-23/h2-4,7-8,11,14,19-20H,5-6,9-10,12-13,15-17H2,1H3/b14-11+/t19-,20?,22+,23?/m0/s1
InChIKey KOOPWMYWCSPPJC-VXXLJJMXSA-N
Mol Weight 386.49 g/mol
Molecular Formula C23H30O5
Exact Mass 386.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AdqMz2hz2hZ
Name (E)-3-[(5R,6aS,9aR)-5-(2-Benzyloxy-ethyl)-octahydro-dicyclopenta[1,3]dioxin-5-yl]-acrylic acid methyl ester
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Formula C23H30O5
InChI InChI=1S/C23H30O5/c1-25-21(24)11-14-23(15-16-26-17-18-7-3-2-4-8-18)27-19-9-5-12-22(19)13-6-10-20(22)28-23/h2-4,7-8,11,14,19-20H,5-6,9-10,12-13,15-17H2,1H3/b14-11+/t19-,20?,22+,23?/m0/s1
InChIKey KOOPWMYWCSPPJC-VXXLJJMXSA-N
Molecular Weight 386.488 g/mol
SMILES C1(O[C@]2(CCC[C@]22C(O1)CCC2)[H])(\C=C\C(=O)OC)CCOCc1ccccc1
SPLASH splash10-00di-3900000000-d329d7de0349dec50bf4
Source of Spectrum KD-12-1752-11
Synonyms Methyl (2E)-3-{(3aR,6aS)-5-[2-(benzyloxy)ethyl]octahydrodicyclopenta[d,e][1,3]dioxin-5-yl}-2-propenoate Methyl (E)-6-benzyloxy-4,4-[(1S,5S,6S)-spiro[4.4]nonylene-1,6-dioxy]-2-hexenoate
Wiley ID 1634532