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.alpha.-D-Galactopyranoside, 1,3,4,6-tetrakis-O-(2,2-dimethyl-1-oxopropyl)-.beta.-D-fructofuranosyl, 4-benzoate 2,3,6-tris(2,2-dimethylpropanoate)
SpectraBase Compound ID BO3sJdCIaoe
InChI InChI=1S/C54H82O19/c1-47(2,3)40(56)63-27-31-33(67-38(55)30-25-23-22-24-26-30)35(69-44(60)51(13,14)15)36(70-45(61)52(16,17)18)39(66-31)73-54(29-65-42(58)49(7,8)9)37(71-46(62)53(19,20)21)34(68-43(59)50(10,11)12)32(72-54)28-64-41(57)48(4,5)6/h22-26,31-37,39H,27-29H2,1-21H3
InChIKey LYKUXZLJUPKXFT-UHFFFAOYSA-N
Mol Weight 1035.2 g/mol
Molecular Formula C54H82O19
Exact Mass 1034.54503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LdBuIYVp1RR
Name .alpha.-D-Galactopyranoside, 1,3,4,6-tetrakis-O-(2,2-dimethyl-1-oxopropyl)-.beta.-D-fructofuranosyl, 4-benzoate 2,3,6-tris(2,2-dimethylpropanoate)
Alternate Name(s) 1,3,4,6-Tetra-O-pivaloyl.beta.-D-fructofuranosyl 4-O-benzoyl-2,3,6-tri-O-pivaloyl.alpha.-D-galactopyranoside 6-({3,4-bis[(2,2-dimethylpropanoyl)oxy]-2,5-bis({[(2,2-dimethylpropanoyl)oxy]methyl})oxolan-2-yl}oxy)-4,5-bis[(2,2-dimethylpropanoyl)oxy]-2-{[(2,2-dimethylpropanoyl)oxy]methyl}oxan-3-yl benzoate
CAS Registry Number 90699-76-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C54H82O19
InChI InChI=1S/C54H82O19/c1-47(2,3)40(56)63-27-31-33(67-38(55)30-25-23-22-24-26-30)35(69-44(60)51(13,14)15)36(70-45(61)52(16,17)18)39(66-31)73-54(29-65-42(58)49(7,8)9)37(71-46(62)53(19,20)21)34(68-43(59)50(10,11)12)32(72-54)28-64-41(57)48(4,5)6/h22-26,31-37,39H,27-29H2,1-21H3
InChIKey LYKUXZLJUPKXFT-UHFFFAOYSA-N
Molecular Weight 1035.231 g/mol
SMILES C1(C(C(OC(C(C)(C)C)=O)C(O1)COC(C(C)(C)C)=O)OC(C(C)(C)C)=O)(OC1C(C(OC(C(C)(C)C)=O)C(C(O1)COC(C(C)(C)C)=O)OC(=O)c1ccccc1)OC(C(C)(C)C)=O)COC(C(C)(C)C)=O
SPLASH splash10-0a4i-9010000000-06dd7349354c1c42a8e4
Source of Spectrum KC-1984-427-0
Wiley ID 1418476