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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3HbhAW4gdSp
Name Trilinolein
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. 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
Molecular Weight 879.405 g/mol
SMILES C(OC(CCCCCCC\C=C/C\C=C/CCCCC)=O)C(OC(CCCCCCC\C=C/C\C=C/CCCCC)=O)COC(CCCCCCC\C=C/C\C=C/CCCCC)=O
SPLASH splash10-002b-0000091070-267fa10d923b014c65d1
Source of Spectrum Ji Ye Lee, et al. Journal of Chromatography A, 10.1016/j.chroma.2016.10.033
Synonyms Propane-1,2,3-triyl (9Z,9'Z,9''Z,12Z,12'Z,12''Z)-tris(octadeca-9,12-dienoate)
Wiley ID 1815176