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L-Glycero-L-talo-nonose, 2,3,7,8-tetradeoxy-2,8-dimethyl-4,6-di-o-methyl-, 1,3-propanediyl mercaptal

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

L-Glycero-L-talo-nonose, 2,3,7,8-tetradeoxy-2,8-dimethyl-4,6-di-o-methyl-, 1,3-propanediyl mercaptal
SpectraBase Compound ID KyKFGPsZWZ2
InChI InChI=1S/C16H32O4S2/c1-11(10-17)8-13(19-3)15(18)14(20-4)9-12(2)16-21-6-5-7-22-16/h11-18H,5-10H2,1-4H3/t11-,12-,13+,14+,15-/m1/s1
InChIKey XCAKDVHYKFPRTI-NIFZNCRKSA-N
Mol Weight 352.5 g/mol
Molecular Formula C16H32O4S2
Exact Mass 352.174202 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DPqGNcVra4G
Name L-Glycero-L-talo-nonose, 2,3,7,8-tetradeoxy-2,8-dimethyl-4,6-di-o-methyl-, 1,3-propanediyl mercaptal
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 352.174201854 u
Formula C16H32O4S2
InChI InChI=1S/C16H32O4S2/c1-11(10-17)8-13(19-3)15(18)14(20-4)9-12(2)16-21-6-5-7-22-16/h11-18H,5-10H2,1-4H3/t11-,12-,13+,14+,15-/m1/s1
InChIKey XCAKDVHYKFPRTI-NIFZNCRKSA-N
Molecular Weight 352.548 g/mol
SMILES [C@@]([C@](C[C@](C1SCCCS1)(C)[H])(OC)[H])([C@](C[C@](CO)(C)[H])(OC)[H])(O)[H]