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Trilinolein

View entire compound with spectra: 2 NMR, and 1 MS (GC)

Trilinolein
SpectraBase Compound ID 4jIWGrtnhGu
InChI InChI=1S/C57H98O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h16-21,25-30,54H,4-15,22-24,31-53H2,1-3H3/b19-16-,20-17-,21-18-,28-25-,29-26-,30-27-
InChIKey HBOQXIRUPVQLKX-BBWANDEASA-N
Mol Weight 879.4 g/mol
Molecular Formula C57H98O6
Exact Mass 878.736341 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BHmzIWPsQNL
Name TRILINOLEIN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C57H98O6
InChI InChI=1S/C57H98O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h16-21,25-30,54H,4-15,22-24,31-53H2,1-3H3/b19-16-,20-17-,21-18-,28-25-,29-26-,30-27-
InChIKey HBOQXIRUPVQLKX-BBWANDEASA-N
Literature Reference Author C.Y.RAGASA,G.S.LORENA,E.H.MANDIA,D.D.RAGA,C.C.SHEN
Literature Reference Citation AM.J.ESS.OIL.NAT.PR.,1,7(2013)
Molecular Weight 879.402 g/mol
Source File Reference UWIR6618