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Methyl 8,1,12-tri(trimethylsiloxy)eicosan-5(Z),9(E),14(Z)-trienoate-8,12-18O2
SpectraBase Compound ID GRFoB68khsg
InChI InChI=1S/C30H60O5Si3/c1-12-13-14-15-16-20-23-28(34-37(6,7)8)29(35-38(9,10)11)26-25-27(33-36(3,4)5)22-19-17-18-21-24-30(31)32-2/h16-17,19-20,25-29H,12-15,18,21-24H2,1-11H3/b19-17-,20-16-,26-25+/i33+2,34+2
InChIKey VTQOHLXHHLKRBA-POESMHNASA-N
Mol Weight 589.1 g/mol
Molecular Formula C30H60O318O2Si3
Exact Mass 588.383345 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AgrPDv9Tajj
Name Methyl 8,1,12-tri(trimethylsiloxy)eicosan-5(Z),9(E),14(Z)-trienoate-8,12-18O2
Comments Original formula: C30H60O3[18O]2Si3
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Formula C30H60O5Si3
InChI InChI=1S/C30H60O5Si3/c1-12-13-14-15-16-20-23-28(34-37(6,7)8)29(35-38(9,10)11)26-25-27(33-36(3,4)5)22-19-17-18-21-24-30(31)32-2/h16-17,19-20,25-29H,12-15,18,21-24H2,1-11H3/b19-17-,20-16-,26-25+/i33+2,34+2
InChIKey VTQOHLXHHLKRBA-POESMHNASA-N
Molecular Weight 589.060 g/mol
SMILES C([18O][Si](C)(C)C)(C(\C=C\C([18O][Si](C)(C)C)C\C=C/CCCC(=O)OC)O[Si](C)(C)C)C\C=C/CCCCC
SPLASH splash10-02t9-0190000000-bad04ac5cc20192e7111
Source of Spectrum B3-0-127-2
Wiley ID 1408838