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(8aR,14bS)-6,7,8,8a,9,14b-hexahydro-5H-,14-dioxapentaphene
SpectraBase Compound ID 7U3YaXbnP6j
InChI InChI=1S/C20H20O2/c1-3-10-18-14(6-1)12-16-8-5-9-17-13-15-7-2-4-11-19(15)22-20(16,17)21-18/h1-4,6-7,10-11,16-17H,5,8-9,12-13H2/t16-,17+,20?
InChIKey MITLHOUXQKXRCL-XEWABKELSA-N
Mol Weight 292.38 g/mol
Molecular Formula C20H20O2
Exact Mass 292.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kk43pn69n4D
Name (8aR,14bS)-6,7,8,8a,9,14b-hexahydro-5H-,14-dioxapentaphene
Appearance White solid
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Formula C20H20O2
InChI InChI=1S/C20H20O2/c1-3-10-18-14(6-1)12-16-8-5-9-17-13-15-7-2-4-11-19(15)22-20(16,17)21-18/h1-4,6-7,10-11,16-17H,5,8-9,12-13H2/t16-,17+,20?
InChIKey MITLHOUXQKXRCL-XEWABKELSA-N
Ionization Type EI
Molecular Weight 292.378 g/mol
Optical Rotation [a]D20 = +4.1 (c = 0.46, CHCl3)
Reported Formula C20H20O2
SMILES c1ccc2c(c1)OC13[C@@](C2)(CCC[C@]3(Cc2c(O1)cccc2)[H])[H]
SPLASH splash10-000l-1930000000-cd9566d5dc67eadf7787
Sample Comments 15% ee
Source of Spectrum CN102424682A
Wiley ID 1866018