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3,3,4,4-Tetrahydro-1,2,3,4,5-pentadeoxy-7,8:9,10-di-O-isopropylidene-D-manno-decitol
SpectraBase Compound ID ITA7RyGspwe
InChI InChI=1S/C16H26O5/c1-6-7-8-9-11(17)13-14(21-16(4,5)20-13)12-10-18-15(2,3)19-12/h11-14,17H,6,9-10H2,1-5H3/t11-,12-,13-,14-/m1/s1
InChIKey XCOWSYAJOBWJBR-AAVRWANBSA-N
Mol Weight 298.38 g/mol
Molecular Formula C16H26O5
Exact Mass 298.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 38Tlb8pVpmp
Name 3,3,4,4-Tetrahydro-1,2,3,4,5-pentadeoxy-7,8:9,10-di-O-isopropylidene-D-manno-decitol
Alternate Name(s) (1R)-1-[(4R,5R)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolan-4-yl]hex-3-yn-1-ol (R)-1-((4R,5R,4'R)-2,2,2',2'-Tetramethyl-[4,4']bi[[1,3]dioxolanyl]-5-yl)-hex-3-yn-1-ol
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Formula C16H26O5
InChI InChI=1S/C16H26O5/c1-6-7-8-9-11(17)13-14(21-16(4,5)20-13)12-10-18-15(2,3)19-12/h11-14,17H,6,9-10H2,1-5H3/t11-,12-,13-,14-/m1/s1
InChIKey XCOWSYAJOBWJBR-AAVRWANBSA-N
Molecular Weight 298.379 g/mol
SMILES O[C@@]([C@@]1([C@@]([C@@]2(OC(C)(C)OC2)[H])(OC(C)(C)O1)[H])[H])(CC#CCC)[H]
SPLASH splash10-000y-0090000000-f2528b18e067735cca98
Source of Spectrum KC-0-3083-11
Wiley ID 780359