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Docosanoic acid, 8,9-dihydroxy-, methyl ester
SpectraBase Compound ID 8OIwyCbssWD
InChI InChI=1S/C23H46O4/c1-3-4-5-6-7-8-9-10-11-12-15-18-21(24)22(25)19-16-13-14-17-20-23(26)27-2/h21-22,24-25H,3-20H2,1-2H3
InChIKey YDMVXCKQLYENMG-UHFFFAOYSA-N
Mol Weight 386.6 g/mol
Molecular Formula C23H46O4
Exact Mass 386.33961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8yBfPbDpdiQ
Name Docosanoic acid, 8,9-dihydroxy-, methyl ester
CAS Registry Number 56555-06-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H46O4
InChI InChI=1S/C23H46O4/c1-3-4-5-6-7-8-9-10-11-12-15-18-21(24)22(25)19-16-13-14-17-20-23(26)27-2/h21-22,24-25H,3-20H2,1-2H3
InChIKey YDMVXCKQLYENMG-UHFFFAOYSA-N
Molecular Weight 386.617 g/mol
SMILES OC(C(CCCCCCCCCCCCC)O)CCCCCCC(OC)=O
SPLASH splash10-00dl-9700000000-f3afebf41cdb66e139ac
Source of Spectrum EP-4996-0-0
Synonyms Methyl 8,9-dihydroxydocosanoate 8,9-Dihydroxybehenic acid methyl ester 8,9-Dihydroxydocosanoic acid methyl ester Methyl 8,9-bis(oxidanyl)docosanoate
Wiley ID 1362815