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.beta.-D-Fructopyranose, 1,3,4,5-tetrakis(4-nitrobenzoate)
SpectraBase Compound ID IO7AUTzfHJN
InChI InChI=1S/C34H24N4O18/c39-30(19-1-9-23(10-2-19)35(44)45)52-18-34(43)29(56-33(42)22-7-15-26(16-8-22)38(50)51)28(55-32(41)21-5-13-25(14-6-21)37(48)49)27(17-53-34)54-31(40)20-3-11-24(12-4-20)36(46)47/h1-16,27-29,43H,17-18H2/t27-,28-,29+,34-/m1/s1
InChIKey NKPXXLJCOFDNQS-DYKCOLQBSA-N
Mol Weight 776.6 g/mol
Molecular Formula C34H24N4O18
Exact Mass 776.10856 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IKG9NJCM6bC
Name .beta.-D-Fructopyranose, 1,3,4,5-tetrakis(4-nitrobenzoate)
CAS Registry Number 70551-40-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H24N4O18
InChI InChI=1S/C34H24N4O18/c39-30(19-1-9-23(10-2-19)35(44)45)52-18-34(43)29(56-33(42)22-7-15-26(16-8-22)38(50)51)28(55-32(41)21-5-13-25(14-6-21)37(48)49)27(17-53-34)54-31(40)20-3-11-24(12-4-20)36(46)47/h1-16,27-29,43H,17-18H2/t27-,28-,29+,34-/m1/s1
InChIKey NKPXXLJCOFDNQS-DYKCOLQBSA-N
Molecular Weight 776.576 g/mol
SMILES O[C@]1([C@]([C@](OC(c2ccc(N(=O)=O)cc2)=O)([C@](OC(c2ccc(N(=O)=O)cc2)=O)(CO1)[H])[H])(OC(c1ccc(N(=O)=O)cc1)=O)[H])COC(c1ccc(N(=O)=O)cc1)=O
SPLASH splash10-0gb9-6900000000-150f38d407e174d3908e
Source of Spectrum H-62-384-0
Synonyms 1,3,4,5-Tetrakis(o-p-nitrobenzoyl)-.beta.-D-fructopyranose 1,3,4,5-tetrakis-O-(4-nitrobenzoyl)-.beta.-D-fructopyranose
Wiley ID 1416817