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4-[(3aS,4R,6R,6aR)-4-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]-1-butanol
SpectraBase Compound ID DOUcULKSY9J
InChI InChI=1S/C16H28O6/c1-15(2)18-9-11(20-15)12-14-13(21-16(3,4)22-14)10(19-12)7-5-6-8-17/h10-14,17H,5-9H2,1-4H3/t10-,11-,12-,13-,14+/m1/s1
InChIKey LQZSZHGABRPSAS-KSTCHIGDSA-N
Mol Weight 316.39 g/mol
Molecular Formula C16H28O6
Exact Mass 316.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JcnzYsRlOLH
Name 4-[(3aS,4R,6R,6aR)-4-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]-1-butanol
Alternate Name(s) 4-[(3aS,4R,6R,6aR)-4-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]butan-1-ol
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Formula C16H28O6
InChI InChI=1S/C16H28O6/c1-15(2)18-9-11(20-15)12-14-13(21-16(3,4)22-14)10(19-12)7-5-6-8-17/h10-14,17H,5-9H2,1-4H3/t10-,11-,12-,13-,14+/m1/s1
InChIKey LQZSZHGABRPSAS-KSTCHIGDSA-N
Molecular Weight 316.394 g/mol
SMILES OCCCC[C@@]1([C@@]2([C@]([C@](O1)([C@@]1(OC(C)(C)OC1)[H])[H])(OC(C)(C)O2)[H])[H])[H]
SPLASH splash10-0udi-0957000000-c3f5cc4b674f2bf21964
Source of Spectrum J-61-4006-28
Wiley ID 1316620