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Lignocerate <ethyl->
SpectraBase Compound ID 5B0ZEq24rvt
InChI InChI=1S/C26H52O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(27)28-4-2/h3-25H2,1-2H3
InChIKey AKXFYSSXNQQBNT-UHFFFAOYSA-N
Mol Weight 396.7 g/mol
Molecular Formula C26H52O2
Exact Mass 396.396731 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LHRaPFEbHnQ
Name Lignocerate
CAS Registry Number 24634-95-5
Classification Fatty esters; Fatty acid ethyl esters
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 396.396730912 u
Formula C26H52O2
InChI InChI=1S/C26H52O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(27)28-4-2/h3-25H2,1-2H3
InChIKey AKXFYSSXNQQBNT-UHFFFAOYSA-N
Molecular Weight 396.700 g/mol
Number of Peaks 50
RI2 2430
RI4 2793
RI5 2461
SMILES C(CCCCCCCCCCCCCCCCCCCCCCC)(=O)OCC
SPLASH splash10-052u-9200000000-d6e68617dd97d1033153
Sample Comments RI1: measured on Equity-1 (Alkanes) RI2: measured on Supelcowax-10 (FAMEs) RI3: measured on Supelcowax-10 (FAEEs) RI4: measured on SLB-5ms (Alkanes) RI5: measured on SLB-5ms (FAMEs)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Tetracosanoic acid, ethyl ester Et. C24:0
Wiley ID LM_LIPIDS2016_106