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4-Oxo-6-hydroxy-heneicosa-14,16,18-triene
SpectraBase Compound ID 5BSjszTbAOJ
InChI InChI=1S/C21H36O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-18-21(23)19-20(22)17-4-2/h5-10,21,23H,3-4,11-19H2,1-2H3/b6-5+,8-7+,10-9+
InChIKey VGHJLGTWOLSQJE-SUTYWZMXSA-N
Mol Weight 320.5 g/mol
Molecular Formula C21H36O2
Exact Mass 320.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cy7Tk4i9lTA
Name 4-Oxo-6-hydroxy-heneicosa-14,16,18-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36O2
InChI InChI=1S/C21H36O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-18-21(23)19-20(22)17-4-2/h5-10,21,23H,3-4,11-19H2,1-2H3/b6-5+,8-7+,10-9+
InChIKey VGHJLGTWOLSQJE-SUTYWZMXSA-N
Molecular Weight 320.517 g/mol
SMILES OC(CC(CCC)=O)CCCCCCC\C=C\C=C\C=C\CC
SPLASH splash10-00kb-6910000000-e2dadade3aff249cbb76
Source of Spectrum G4-60-1147-7
Synonyms (14E,16E,18E)-6-hydroxy-14,16,18-henicosatrien-4-one
Wiley ID 1606962