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Lignoceric acid, dimethyl(pentafluorophenyl)silyl ester
SpectraBase Compound ID 4mTGBIb03gp
InChI InChI=1S/C32H53F5O2Si/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(38)39-40(2,3)32-30(36)28(34)27(33)29(35)31(32)37/h4-25H2,1-3H3
InChIKey OWFNBRHFIACQSN-UHFFFAOYSA-N
Mol Weight 592.9 g/mol
Molecular Formula C32H53F5O2Si
Exact Mass 592.373498 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AjHqRO2Ooj5
Name Lignoceric acid, dimethyl(pentafluorophenyl)silyl ester
Comments Computed using HOSE algorithm
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Exact Mass 592.373498295 u
Formula C32H53F5O2Si
InChI InChI=1S/C32H53F5O2Si/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(38)39-40(2,3)32-30(36)28(34)27(33)29(35)31(32)37/h4-25H2,1-3H3
InChIKey OWFNBRHFIACQSN-UHFFFAOYSA-N
Molecular Weight 592.851 g/mol
SMILES CCCCCCCCCCCCCCCCCCCCCCCC(O[Si](C)(C)C=1C(=C(C(=C(C1F)F)F)F)F)=O