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(5Z,8R,9E,11Z,14Z,17Z)-8-hydroxyeicosa-5,9,11,14,17-pentaenoic acid
SpectraBase Compound ID 7x8XOl4YlGa
InChI InChI=1S/C20H30O3/c1-2-3-4-5-6-7-8-9-10-13-16-19(21)17-14-11-12-15-18-20(22)23/h3-4,6-7,9-11,13-14,16,19,21H,2,5,8,12,15,17-18H2,1H3,(H,22,23)/b4-3-,7-6-,10-9-,14-11-,16-13+/t19-/m0/s1
InChIKey WLOUCHKFBGGNEB-CLXNAOOQSA-N
Mol Weight 318.46 g/mol
Molecular Formula C20H30O3
Exact Mass 318.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H1GjeNtI0Bt
Name (5Z,8R,9E,11Z,14Z,17Z)-8-hydroxyeicosa-5,9,11,14,17-pentaenoic acid
CAS Registry Number 117407-06-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O3
InChI InChI=1S/C20H30O3/c1-2-3-4-5-6-7-8-9-10-13-16-19(21)17-14-11-12-15-18-20(22)23/h3-4,6-7,9-11,13-14,16,19,21H,2,5,8,12,15,17-18H2,1H3,(H,22,23)/b4-3-,7-6-,10-9-,14-11-,16-13+/t19-/m0/s1
InChIKey WLOUCHKFBGGNEB-CLXNAOOQSA-N
Molecular Weight 318.457 g/mol
SMILES OC(CCC\C=C/C[C@](\C=C\C=C/C\C=C/C\C=C/CC)(O)[H])=O
SPLASH splash10-0006-9000000000-60cb9da85774f5caf73d
Source of Spectrum H-71-1099-0
Synonyms (5Z,8R,9E,11Z,14Z,17Z)-8-hydroxyicosa-5,9,11,14,17-pentaenoic acid (5Z,8R,9E,11Z,14Z,17Z)-8-oxidanylicosa-5,9,11,14,17-pentaenoic acid
Wiley ID 1318804