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21-Hydroxyheneicosanoate <methyl->
SpectraBase Compound ID 4uuM1vWE47c
InChI InChI=1S/C22H44O3/c1-25-22(24)20-18-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-19-21-23/h23H,2-21H2,1H3
InChIKey YCYYZXLJQNQRSH-UHFFFAOYSA-N
Mol Weight 356.6 g/mol
Molecular Formula C22H44O3
Exact Mass 356.329045 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KfZsThyMVBD
Name 21-Hydroxyheneicosanoate
CAS Registry Number 94035-98-0
Classification Fatty esters; Fatty acid methyl esters
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H44O3
InChI InChI=1S/C22H44O3/c1-25-22(24)20-18-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-19-21-23/h23H,2-21H2,1H3
InChIKey YCYYZXLJQNQRSH-UHFFFAOYSA-N
Number of Peaks 301
RI4 2726
RI5 2393
SMILES C(CCCCCCCCCCCCCCCCCCCCO)(=O)OC
SPLASH splash10-05te-9200000000-b1be6f7a2c02a9eb2889
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Heneicosanoic acid, 21-hydroxy-, methyl ester Me. 21-OH C21:0
Wiley ID LM_LIPIDS2016_232