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Cellobiose, 8tms
SpectraBase Compound ID 9BwazYKpB0Z
InChI InChI=1S/C36H86O11Si8/c1-48(2,3)37-25-27-29(31(43-51(10,11)12)34(46-54(19,20)21)36(40-27)47-55(22,23)24)41-35-33(45-53(16,17)18)32(44-52(13,14)15)30(42-50(7,8)9)28(39-35)26-38-49(4,5)6/h27-36H,25-26H2,1-24H3/t27-,28-,29-,30-,31+,32+,33-,34-,35+,36+/m1/s1
InChIKey QJZFVYJIGWEKIR-OPJDJTOASA-N
Mol Weight 919.8 g/mol
Molecular Formula C36H86O11Si8
Exact Mass 918.432426 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ce2aixWvivd
Name Cellobiose, 8tms
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 918.432425858 u
Formula C36H86O11Si8
InChI InChI=1S/C36H86O11Si8/c1-48(2,3)37-25-27-29(31(43-51(10,11)12)34(46-54(19,20)21)36(40-27)47-55(22,23)24)41-35-33(45-53(16,17)18)32(44-52(13,14)15)30(42-50(7,8)9)28(39-35)26-38-49(4,5)6/h27-36H,25-26H2,1-24H3/t27-,28-,29-,30-,31+,32+,33-,34-,35+,36+/m1/s1
InChIKey QJZFVYJIGWEKIR-OPJDJTOASA-N
Molecular Weight 919.753 g/mol
SMILES C([C@@]1([C@]([C@@]([C@]([C@@](O1)(O[C@@]1([C@@](CO[Si](C)(C)C)(O[C@]([C@@]([C@]1(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])[H])[H])[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])[H])O[Si](C)(C)C