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8-[(2S,3S,5S)-3-acetoxy-5-[(1S)-1-hydroxyhexyl]tetrahydrofuran-2-yl]caprylic acid methyl ester
SpectraBase Compound ID 8ZImDPZQqsV
InChI InChI=1S/C21H38O6/c1-4-5-9-12-17(23)19-15-20(26-16(2)22)18(27-19)13-10-7-6-8-11-14-21(24)25-3/h17-20,23H,4-15H2,1-3H3/t17-,18-,19-,20-/m0/s1
InChIKey QOXIIWDUNJHTJN-MUGJNUQGSA-N
Mol Weight 386.5 g/mol
Molecular Formula C21H38O6
Exact Mass 386.266839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AuWesI71Qxq
Name 8-[(2S,3S,5S)-3-acetoxy-5-[(1S)-1-hydroxyhexyl]tetrahydrofuran-2-yl]caprylic acid methyl ester
Alternate Name(s) 8-[(2S,3S,5S)-3-acetyloxy-5-[(1S)-1-hydroxyhexyl]-2-oxolanyl]octanoic acid methyl ester Methyl 8-[(2S,3S,5S)-3-acetoxy-5-[(1S)-1-hydroxyhexyl]tetrahydrofuran-2-yl]octanoate Methyl 8-[(2S,3S,5S)-3-acetyloxy-5-[(1S)-1-hydroxyhexyl]oxolan-2-yl]octanoate Methyl 8-[(2S,3S,5S)-3-acetyloxy-5-[(1S)-1-oxidanylhexyl]oxolan-2-yl]octanoate
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Formula C21H38O6
InChI InChI=1S/C21H38O6/c1-4-5-9-12-17(23)19-15-20(26-16(2)22)18(27-19)13-10-7-6-8-11-14-21(24)25-3/h17-20,23H,4-15H2,1-3H3/t17-,18-,19-,20-/m0/s1
InChIKey QOXIIWDUNJHTJN-MUGJNUQGSA-N
Molecular Weight 386.529 g/mol
SMILES O[C@]([C@]1(O[C@]([C@@](OC(=O)C)(C1)[H])(CCCCCCCC(=O)OC)[H])[H])(CCCCC)[H]
SPLASH splash10-004i-1890000000-d606416464489ecbb254
Source of Spectrum F-54-2237-12
Wiley ID 805929