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2-{(E)-3-[6,6-(Dimethoxy)hexyloxy]propen-1-yl}-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
SpectraBase Compound ID GMgwNrHlqF8
InChI InChI=1S/C17H33BO5/c1-16(2)17(3,4)23-18(22-16)12-10-14-21-13-9-7-8-11-15(19-5)20-6/h10,12,15H,7-9,11,13-14H2,1-6H3/b12-10+
InChIKey UQFOCACXQQCAEN-ZRDIBKRKSA-N
Mol Weight 328.3 g/mol
Molecular Formula C17H33BO5
Exact Mass 328.242104 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HfR51kCPq1U
Name 2-{(E)-3-[6,6-(Dimethoxy)hexyloxy]propen-1-yl}-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Comments Computed using HOSE algorithm
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Exact Mass 328.242104328 u
Formula C17H33BO5
InChI InChI=1S/C17H33BO5/c1-16(2)17(3,4)23-18(22-16)12-10-14-21-13-9-7-8-11-15(19-5)20-6/h10,12,15H,7-9,11,13-14H2,1-6H3/b12-10+
InChIKey UQFOCACXQQCAEN-ZRDIBKRKSA-N
Molecular Weight 328.256 g/mol
SMILES C1(OB(OC1(C)C)\C=C\COCCCCCC(OC)OC)(C)C