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(9R,4aR,8aR,9a.epison.,10a.epison.)-9-(Benzyloxy)octahydro-1,8,10-trioxaanthracen-4a-ol
SpectraBase Compound ID CyeKHuSyoTR
InChI InChI=1S/C18H24O5/c19-18-9-5-11-21-17(18)16(15-14(23-18)8-4-10-20-15)22-12-13-6-2-1-3-7-13/h1-3,6-7,14-17,19H,4-5,8-12H2/t14-,15+,16+,17+,18+/m0/s1
InChIKey VAFWYBHSAHCFBS-YYWYGQEZSA-N
Mol Weight 320.39 g/mol
Molecular Formula C18H24O5
Exact Mass 320.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ClhxIHbskF2
Name (9R,4aR,8aR,9a.epison.,10a.epison.)-9-(Benzyloxy)octahydro-1,8,10-trioxaanthracen-4a-ol
Alternate Name(s) (1R,8R,9R)-9-(benzyloxy)-2,7,11-trioxatricyclo[8.4.0.0(3,8)]tetradecan-1-ol (4aR,8aR,9R,9aR,10aS)-9-Benzyloxy-octahydro-1,8,10-trioxa-anthracen-4a-ol
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Formula C18H24O5
InChI InChI=1S/C18H24O5/c19-18-9-5-11-21-17(18)16(15-14(23-18)8-4-10-20-15)22-12-13-6-2-1-3-7-13/h1-3,6-7,14-17,19H,4-5,8-12H2/t14-,15+,16+,17+,18+/m0/s1
InChIKey VAFWYBHSAHCFBS-YYWYGQEZSA-N
Molecular Weight 320.385 g/mol
SMILES O[C@]12[C@@]([C@@]([C@@]3(OCCC[C@@]3(O2)[H])[H])(OCc2ccccc2)[H])(OCCC1)[H]
SPLASH splash10-05wu-9100000000-a9fd23a16ee9cfb7b94a
Source of Spectrum J-61-3016-63
Wiley ID 1320166