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(1S,1'R/S)-3-Deoxy-1,2-O-isopropylidene-4,5-di-O-methyl-1-(2'-oxo-1'-cyclohexyl)-D-arabinitol-3-one
SpectraBase Compound ID H5z8e46zv7P
InChI InChI=1S/C16H26O6/c1-16(2)21-14(10-7-5-6-8-11(10)17)15(22-16)13(18)12(20-4)9-19-3/h10,12,14-15H,5-9H2,1-4H3/t10?,12-,14+,15-/m1/s1
InChIKey SDHFAAWNDWFFGT-HZBOJJJBSA-N
Mol Weight 314.38 g/mol
Molecular Formula C16H26O6
Exact Mass 314.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CUL3aQlMoOc
Name (1S,1'R/S)-3-Deoxy-1,2-O-isopropylidene-4,5-di-O-methyl-1-(2'-oxo-1'-cyclohexyl)-D-arabinitol-3-one
Alternate Name(s) 2-[(4S,5S)-5-((R)-2,3-Dimethoxy-propionyl)-2,2-dimethyl-[1,3]dioxolan-4-yl]-cyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O6
InChI InChI=1S/C16H26O6/c1-16(2)21-14(10-7-5-6-8-11(10)17)15(22-16)13(18)12(20-4)9-19-3/h10,12,14-15H,5-9H2,1-4H3/t10?,12-,14+,15-/m1/s1
InChIKey SDHFAAWNDWFFGT-HZBOJJJBSA-N
Molecular Weight 314.378 g/mol
SMILES [C@@]1([C@@](OC(O1)(C)C)(C1C(=O)CCCC1)[H])(C([C@](OC)(COC)[H])=O)[H]
SPLASH splash10-000i-1900000000-42dc1b1efb7e56d0beae
Source of Spectrum J-73-5295-54
Wiley ID 1668414