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(-)-6-O-Benzyl-2,3:4,5-di-O-cyclohexylidene-1-O-(p-methoxybenzyl)-myo-inositol
SpectraBase Compound ID 2eShDe6DIMz
InChI InChI=1S/C33H42O7/c1-34-25-15-13-24(14-16-25)22-36-27-26(35-21-23-11-5-2-6-12-23)28-30(39-32(37-28)17-7-3-8-18-32)31-29(27)38-33(40-31)19-9-4-10-20-33/h2,5-6,11-16,26-31H,3-4,7-10,17-22H2,1H3/t26-,27-,28+,29-,30-,31-/m1/s1
InChIKey VBTXJDFEFLIVEZ-UJDDCBASSA-N
Mol Weight 550.7 g/mol
Molecular Formula C33H42O7
Exact Mass 550.293054 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GyS9NI5eCWE
Name (-)-6-O-Benzyl-2,3:4,5-di-O-cyclohexylidene-1-O-(p-methoxybenzyl)-myo-inositol
Alternate Name(s) (1'R,2'R,6'S,7'R,8'R,9'R)-7'-(benzyloxy)-8'-[(4-methoxyphenyl)methoxy]dispiro[cyclohexane-1,4'-[3,5,10,12]tetraoxatricyclo[7.3.0.0(2,6)]dodecane-11',1''-cyclohexane]
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Formula C33H42O7
InChI InChI=1S/C33H42O7/c1-34-25-15-13-24(14-16-25)22-36-27-26(35-21-23-11-5-2-6-12-23)28-30(39-32(37-28)17-7-3-8-18-32)31-29(27)38-33(40-31)19-9-4-10-20-33/h2,5-6,11-16,26-31H,3-4,7-10,17-22H2,1H3/t26-,27-,28+,29-,30-,31-/m1/s1
InChIKey VBTXJDFEFLIVEZ-UJDDCBASSA-N
Molecular Weight 550.692 g/mol
SMILES [C@]12([C@]3([C@@](OC4(O3)CCCCC4)([C@@]([C@]([C@]2(OC2(O1)CCCCC2)[H])(OCc1ccc(cc1)OC)[H])(OCc1ccccc1)[H])[H])[H])[H]
SPLASH splash10-00di-0900310000-662495a0ea43a0178fd8
Source of Spectrum J-61-5907-4
Wiley ID 1405762