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1-Trideuterioacetyl-.beta.-D-glucopyranose tetraacetate
SpectraBase Compound ID L3VD5ayYP5j
InChI InChI=1S/C16H22O11/c1-7(18)16(26-11(5)22)15(25-10(4)21)14(24-9(3)20)13(23-8(2)19)12(6-17)27-16/h12-15,17H,6H2,1-5H3/t12-,13-,14+,15-,16-/m1/s1/i1D3
InChIKey JTVREEZCDWPDRF-TZXAZRCUSA-N
Mol Weight 393.36 g/mol
Molecular Formula C16H192D3O11
Exact Mass 393.135042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BHFRHbqZ3Rc
Name 1-Trideuterioacetyl-.beta.-D-glucopyranose tetraacetate
CAS Registry Number 55823-00-2
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19D3O11
InChI InChI=1S/C16H22O11/c1-7(18)16(26-11(5)22)15(25-10(4)21)14(24-9(3)20)13(23-8(2)19)12(6-17)27-16/h12-15,17H,6H2,1-5H3/t12-,13-,14+,15-,16-/m1/s1/i1D3
InChIKey JTVREEZCDWPDRF-TZXAZRCUSA-N
Molecular Weight 393.359 g/mol
SMILES OC[C@@]1([C@@](OC(=O)C)([C@@]([C@]([C@@](O1)(OC(=O)C)C(=O)C([2D])([2D])[2D])(OC(=O)C)[H])(OC(=O)C)[H])[H])[H]
SPLASH splash10-05mk-5910000000-a542dc8400062d9032cb
Source of Spectrum C-85-1765-3
Wiley ID 1364549