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2-Deoxy-D-glucose diethyl dithioacetal tetraacetate-D12
SpectraBase Compound ID 3AxKcpu7P9Z
InChI InChI=1S/C18H30O8S2/c1-7-27-17(28-8-2)9-15(24-12(4)20)18(26-14(6)22)16(25-13(5)21)10-23-11(3)19/h15-18H,7-10H2,1-6H3/t15-,16-,18+/m1/s1/i3D3,4D3,5D3,6D3
InChIKey GHJXNKAVPZFZKO-SQYJWORGSA-N
Mol Weight 450.62 g/mol
Molecular Formula C18H182D12O8S2
Exact Mass 450.213531 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I7gsQqY0dJ
Name 2-Deoxy-D-glucose diethyl dithioacetal tetraacetate-D12
CAS Registry Number 55759-89-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18D12O8S2
InChI InChI=1S/C18H30O8S2/c1-7-27-17(28-8-2)9-15(24-12(4)20)18(26-14(6)22)16(25-13(5)21)10-23-11(3)19/h15-18H,7-10H2,1-6H3/t15-,16-,18+/m1/s1/i3D3,4D3,5D3,6D3
InChIKey GHJXNKAVPZFZKO-SQYJWORGSA-N
Molecular Weight 450.623 g/mol
SMILES [C@@]([C@@](CC(SCC)SCC)(OC(=O)C([2D])([2D])[2D])[H])([C@](OC(=O)C([2D])([2D])[2D])(COC(=O)C([2D])([2D])[2D])[H])(OC(=O)C([2D])([2D])[2D])[H]
SPLASH splash10-0002-9200000000-a655df2abf75e42461ea
Source of Spectrum C-86-3150-4
Wiley ID 1384001