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Methyl (8S,9R,5Z,10Z,12E,14Z,17Z)-8,9-Isopropylidenedioxy-5,10,12,14,17-eicosapentaenoate
SpectraBase Compound ID xjy4HxhbDs
InChI InChI=1S/C24H36O4/c1-5-6-7-8-9-10-11-12-15-18-21-22(28-24(2,3)27-21)19-16-13-14-17-20-23(25)26-4/h6-7,9-13,15-16,18,21-22H,5,8,14,17,19-20H2,1-4H3/b7-6-,10-9-,12-11+,16-13-,18-15-/t21-,22+/m1/s1
InChIKey YKICMRFPMZTNJO-RXXALROYSA-N
Mol Weight 388.5 g/mol
Molecular Formula C24H36O4
Exact Mass 388.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6VEx9EE7tGE
Name Methyl (8S,9R,5Z,10Z,12E,14Z,17Z)-8,9-Isopropylidenedioxy-5,10,12,14,17-eicosapentaenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36O4
InChI InChI=1S/C24H36O4/c1-5-6-7-8-9-10-11-12-15-18-21-22(28-24(2,3)27-21)19-16-13-14-17-20-23(25)26-4/h6-7,9-13,15-16,18,21-22H,5,8,14,17,19-20H2,1-4H3/b7-6-,10-9-,12-11+,16-13-,18-15-/t21-,22+/m1/s1
InChIKey YKICMRFPMZTNJO-RXXALROYSA-N
Molecular Weight 388.548 g/mol
SMILES C1(O[C@](\C=C/C=C/C=C\C\C=C/CC)([C@@](O1)(C\C=C/CCCC(=O)OC)[H])[H])(C)C
SPLASH splash10-03di-0943000000-60bb5d7ca4e71224d104
Source of Spectrum F-50-7399-31
Synonyms Methyl (5Z)-7-{(4S,5R)-2,2-dimethyl-5-[(1Z,3E,5Z,8Z)-1,3,5,8-undecatetraenyl]-1,3-dioxolan-4-yl}-5-heptenoate
Wiley ID 1364049