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2,6-Anhydro-3,4,5-tri-O-benzoyl-1-deoxyhexitol
SpectraBase Compound ID JoXSIsTSusk
InChI InChI=1S/C27H24O7/c1-18-23(33-26(29)20-13-7-3-8-14-20)24(34-27(30)21-15-9-4-10-16-21)22(17-31-18)32-25(28)19-11-5-2-6-12-19/h2-16,18,22-24H,17H2,1H3
InChIKey REWPKUADPQTEFG-UHFFFAOYSA-N
Mol Weight 460.48 g/mol
Molecular Formula C27H24O7
Exact Mass 460.152203 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Il4XxiY2g1V
Name 2,6-Anhydro-3,4,5-tri-O-benzoyl-1-deoxyhexitol
Alternate Name(s) 1,5-Anhydro-l-rhamnitol tribenzoate benzoic acid (4,5-dibenzoyloxy-6-methyl-3-oxanyl) ester (4,5-dibenzoyloxy-6-methyloxan-3-yl) benzoate (4,5-dibenzoyloxy-6-methyl-tetrahydropyran-3-yl) benzoate [6-methyl-4,5-bis(phenylcarbonyloxy)oxan-3-yl] benzoate
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Formula C27H24O7
InChI InChI=1S/C27H24O7/c1-18-23(33-26(29)20-13-7-3-8-14-20)24(34-27(30)21-15-9-4-10-16-21)22(17-31-18)32-25(28)19-11-5-2-6-12-19/h2-16,18,22-24H,17H2,1H3
InChIKey REWPKUADPQTEFG-UHFFFAOYSA-N
Molecular Weight 460.482 g/mol
SMILES C1(C(COC(C1OC(=O)c1ccccc1)C)OC(=O)c1ccccc1)OC(=O)c1ccccc1
SPLASH splash10-0aor-2950000000-be8584c712f948d09cf1
Source of Spectrum NP-15-4013-0
Wiley ID 1112501