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(5S)-5-[(2S,5S)-5-[(1S)-1-hydroxytridecyl]oxolan-2-yl]oxolan-2-one
SpectraBase Compound ID L6WWleRYb5u
InChI InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-17(22)18-13-14-19(24-18)20-15-16-21(23)25-20/h17-20,22H,2-16H2,1H3/t17-,18-,19-,20-/m0/s1
InChIKey RMIZIDDWTWGDBZ-MUGJNUQGSA-N
Mol Weight 354.5 g/mol
Molecular Formula C21H38O4
Exact Mass 354.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3hkn2Vvt44
Name (5S)-5-[(2S,5S)-5-[(1S)-1-hydroxytridecyl]oxolan-2-yl]oxolan-2-one
Alternate Name(s) (5S)-5-[(2S,5S)-5-[(1S)-1-hydroxytridecyl]-2-oxolanyl]-2-oxolanone (5S)-5-[(2S,5S)-5-[(1S)-1-oxidanyltridecyl]oxolan-2-yl]oxolan-2-one
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Formula C21H38O4
InChI InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-17(22)18-13-14-19(24-18)20-15-16-21(23)25-20/h17-20,22H,2-16H2,1H3/t17-,18-,19-,20-/m0/s1
InChIKey RMIZIDDWTWGDBZ-MUGJNUQGSA-N
Molecular Weight 354.531 g/mol
SMILES O[C@]([C@]1(O[C@]([C@]2(OC(=O)CC2)[H])(CC1)[H])[H])(CCCCCCCCCCCC)[H]
SPLASH splash10-074i-7910000000-4a50fb847c97a22861c7
Source of Spectrum AT-34-8096-3
Wiley ID 852643