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2-Acetamido-D3-2-deoxy-D-galactosediethyl dithioacetal
SpectraBase Compound ID 18mBtE41W7r
InChI InChI=1S/C12H25NO5S2/c1-4-19-12(20-5-2)9(13-7(3)15)11(18)10(17)8(16)6-14/h8-12,14,16-18H,4-6H2,1-3H3,(H,13,15)/t8-,9-,10+,11-/m1/s1/i3D3
InChIKey FMIWWNDUNIUAHX-ZFQIELPJSA-N
Mol Weight 330.47 g/mol
Molecular Formula C12H222D3NO5S2
Exact Mass 330.136245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7UBptaSVwKT
Name 2-Acetamido-D3-2-deoxy-D-galactosediethyl dithioacetal
CAS Registry Number 3509-31-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22D3NO5S2
InChI InChI=1S/C12H25NO5S2/c1-4-19-12(20-5-2)9(13-7(3)15)11(18)10(17)8(16)6-14/h8-12,14,16-18H,4-6H2,1-3H3,(H,13,15)/t8-,9-,10+,11-/m1/s1/i3D3
InChIKey FMIWWNDUNIUAHX-ZFQIELPJSA-N
Molecular Weight 330.472 g/mol
SMILES O[C@@]([C@@]([C@@]([C@@](NC(=O)C([2D])([2D])[2D])(C(SCC)SCC)[H])(O)[H])(O)[H])(CO)[H]
SPLASH splash10-03g1-6900000000-7753e5e5e15e0085a20a
Source of Spectrum C-87-3745-2
Wiley ID 1325346