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[(2R,4aR,6S,7S,8S,8aR)-8-acetoxy-6-benzyl-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] acetate
SpectraBase Compound ID 44fzbQZYZkL
InChI InChI=1S/C23H24O7/c1-14(24)27-21-19(16-9-5-3-6-10-16)29-18-13-26-23(17-11-7-4-8-12-17)30-20(18)22(21)28-15(2)25/h3-12,18-23H,13H2,1-2H3/t18-,19+,20-,21+,22+,23-/m1/s1
InChIKey TWOKERFRQGYCFQ-LLFXUEIYSA-N
Mol Weight 412.44 g/mol
Molecular Formula C23H24O7
Exact Mass 412.152203 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LICP4CPtmAz
Name [(2R,4aR,6S,7S,8S,8aR)-8-acetoxy-6-benzyl-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] acetate
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Formula C23H24O7
InChI InChI=1S/C23H24O7/c1-14(24)27-21-19(16-9-5-3-6-10-16)29-18-13-26-23(17-11-7-4-8-12-17)30-20(18)22(21)28-15(2)25/h3-12,18-23H,13H2,1-2H3/t18-,19+,20-,21+,22+,23-/m1/s1
InChIKey TWOKERFRQGYCFQ-LLFXUEIYSA-N
Ionization Type EI
Molecular Weight 412.438 g/mol
Optical Rotation [a]D20 = -78.46 (c = 1.010, CHCl3)
SMILES [C@@]1([C@]([C@]2([C@](O[C@]1(c1ccccc1)[H])(CO[C@](O2)(c1ccccc1)[H])[H])[H])(OC(=O)C)[H])(OC(C)=O)[H]
SPLASH splash10-0006-9300000000-855b0dd6eff4e3830e14
Source of Spectrum CA2512713C
Thin-Layer Chromatography Rf= 0.21 (cyclohexane/EtOAc, 85:15)
Wiley ID 1844504