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Oleic acid glycerol ester 2AC       @
SpectraBase Compound ID FsD5PpLP1Py
InChI InChI=1S/C25H44O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)30-21-24(31-23(3)27)20-29-22(2)26/h11-12,24H,4-10,13-21H2,1-3H3/b12-11+
InChIKey KXLSJQTXSAYFDL-VAWYXSNFSA-N
Mol Weight 440.6 g/mol
Molecular Formula C25H44O6
Exact Mass 440.313789 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LTC4Nbeyvvi
Name Oleic acid glycerol ester 2AC @
CAS Registry Number 55401-64-4
Classification Fatty acid
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Exact Mass 440.313789131 u
Formula C25H44O6
InChI InChI=1S/C25H44O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)30-21-24(31-23(3)27)20-29-22(2)26/h11-12,24H,4-10,13-21H2,1-3H3/b12-11+
InChIKey KXLSJQTXSAYFDL-VAWYXSNFSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 440.621 g/mol
SMILES C(OC(COC(=O)CCCCCCC\C=C\CCCCCCCC)COC(=O)C)(=O)C
SPLASH splash10-07w9-6942000000-f0d43ef50a68e9b29741
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Sample Preparation Procedure Detected: UHYAC
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Glyceryl monooleate 2AC
Technique GC/MS
Wiley ID MMPW6e_5602