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3-(Heptadecanoyloxy)-2-((trimethylsilyl)oxy)propyl oleate
SpectraBase Compound ID CTyit6B92Zj
InChI InChI=1S/C41H80O5Si/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-41(43)45-38-39(46-47(3,4)5)37-44-40(42)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20,22,39H,6-19,21,23-38H2,1-5H3/b22-20-
InChIKey JPKFYKCACWZPEQ-XDOYNYLZSA-N
Mol Weight 681.2 g/mol
Molecular Formula C41H80O5Si
Exact Mass 680.577502 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1FDvuK8oJPM
Name 3-(Heptadecanoyloxy)-2-((trimethylsilyl)oxy)propyl oleate
Comments Computed using HOSE algorithm
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Exact Mass 680.577502206 u
Formula C41H80O5Si
InChI InChI=1S/C41H80O5Si/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-41(43)45-38-39(46-47(3,4)5)37-44-40(42)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20,22,39H,6-19,21,23-38H2,1-5H3/b22-20-
InChIKey JPKFYKCACWZPEQ-XDOYNYLZSA-N
Molecular Weight 681.171 g/mol
SMILES C(CCCCCCC\C=C/CCCCCCCC)(=O)OCC(COC(CCCCCCCCCCCCCCCC)=O)O[Si](C)(C)C