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Eicosapentaenoic acid, tms derivative
SpectraBase Compound ID KEBLmfs7r35
InChI InChI=1S/C23H38O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-26(2,3)4/h6-7,9-10,12-13,15-16,18-19H,5,8,11,14,17,20-22H2,1-4H3/b7-6-,10-9-,13-12-,16-15-,19-18-
InChIKey HNOHDFAKOUJBRG-WMPRHZDHSA-N
Mol Weight 374.6 g/mol
Molecular Formula C23H38O2Si
Exact Mass 374.264107 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Bg9kbdDa
Name Eicosapentaenoic acid, tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 374.264106997 u
Formula C23H38O2Si
InChI InChI=1S/C23H38O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-26(2,3)4/h6-7,9-10,12-13,15-16,18-19H,5,8,11,14,17,20-22H2,1-4H3/b7-6-,10-9-,13-12-,16-15-,19-18-
InChIKey HNOHDFAKOUJBRG-WMPRHZDHSA-N
Molecular Weight 374.640 g/mol
SMILES C(=O)(O[Si](C)(C)C)CCC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC