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Octa-O-acetyl D-(+)-sucrose

View entire compound with spectra: 6 NMR, 10 FTIR, 2 Raman, and 1 MS (GC)

Octa-O-acetyl D-(+)-sucrose
SpectraBase Compound ID 2hoMmraV694
InChI InChI=1S/C28H38O19/c1-12(29)37-9-20-22(40-15(4)32)24(42-17(6)34)25(43-18(7)35)27(45-20)47-28(11-39-14(3)31)26(44-19(8)36)23(41-16(5)33)21(46-28)10-38-13(2)30/h20-27H,9-11H2,1-8H3/t20-,21-,22-,23-,24+,25-,26+,27-,28+/m1/s1
InChIKey ZIJKGAXBCRWEOL-SAXBRCJISA-N
Mol Weight 678.6 g/mol
Molecular Formula C28H38O19
Exact Mass 678.200729 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E2u6aS2zipr
Name .alpha.-D-Glucopyranoside, 1,3,4,6-tetra-O-acetyl-.beta.-D-fructofuranosyl, tetraacetate
Alternate Name(s) 1,3,4,6-Tetra-O-acetylhex-2-ulofuranosyl 2,3,4,6-tetra-O-acetylhexopyranoside 2,3,4,6,1',3',4',6'-octa-O-acetylsucrose D-(+)-Sucrose octaacetate Octa-O-acetylsucrose Octaacetyl sucrose Saccharose octaacetate SOA Sucrose, octaacetate [3,4,5-triacetoxy-6-[3,4-diacetoxy-2,5-bis(acetoxymethyl)tetrahydrofuran-2-yl]oxy-tetrahydropyran-2-yl]methyl acetate [3,4,5-triacetyloxy-6-[3,4-diacetyloxy-2,5-bis(acetyloxymethyl)oxolan-2-yl]oxy-oxan-2-yl]methyl ethanoate [3,4,5-triacetyloxy-6-[3,4-diacetyloxy-2,5-bis(acetyloxymethyl)oxolan-2-yl]oxyoxan-2-yl]methyl acetate Acetic acid [3,4,5-triacetyloxy-6-[[3,4-diacetyloxy-2,5-bis(acetyloxymethyl)-2-oxolanyl]oxy]-2-oxanyl]methyl ester 2-(acetoxymethyl)-6-((3,4-diacetoxy-2,5-bis(acetoxymethyl)tetrahydrofuran-2-yl)oxy)tetrahydro-2H-pyran-3,4,5-triyl triacetate AI3-00071 BRN 0079290 EINECS 204-772-1 FEMA NO. 3038 NSC 1695
CAS Registry Number 126-14-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H38O19
InChI InChI=1S/C28H38O19/c1-12(29)37-9-20-22(40-15(4)32)24(42-17(6)34)25(43-18(7)35)27(45-20)47-28(11-39-14(3)31)26(44-19(8)36)23(41-16(5)33)21(46-28)10-38-13(2)30/h20-27H,9-11H2,1-8H3/t20-,21-,22-,23-,24+,25-,26+,27-,28+/m1/s1
InChIKey ZIJKGAXBCRWEOL-SAXBRCJISA-N
Molecular Weight 678.593 g/mol
SMILES CC(O[C@]1([C@](O[C@@]([C@]([C@@]1(OC(=O)C)[H])(OC(=O)C)[H])(COC(=O)C)[H])(O[C@@]1(O[C@@]([C@]([C@@]1(OC(=O)C)[H])(OC(=O)C)[H])(COC(=O)C)[H])COC(=O)C)[H])[H])=O
SPLASH splash10-0006-9610000000-1bc72d9be775cb6af2ac
Source of Spectrum HE-1982-0-0
Wiley ID 1414249