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(+)-(12R*,4Z,7Z,10Z,12E,16Z)-METHYL-14-HYDROXY-4,7,10,12,16-DOCOSAPENTAENOATE
SpectraBase Compound ID 9KGQWVY6cDY
InChI InChI=1S/C23H36O3/c1-3-4-5-6-13-16-19-22(24)20-17-14-11-9-7-8-10-12-15-18-21-23(25)26-2/h7-8,11-17,20,22,24H,3-6,9-10,18-19,21H2,1-2H3/b8-7-,14-11-,15-12-,16-13-,20-17+
InChIKey KQROFSUVOAKGFX-OPDJUUHMSA-N
Mol Weight 360.5 g/mol
Molecular Formula C23H36O3
Exact Mass 360.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9LD3z7LfpT5
Name Methyl (4Z,7Z,10Z,12E,16Z)-14-hydroxy-4,7,10,12,16-docosapentaen-1-oate
Alternate Name(s) Methyl (12R*,4Z,7Z,10Z,12E,16Z)-14-hydroxy-4,7,10,12,16-docosapentaen-1-oate Methyl (4Z,7Z,10Z,12E,16Z)-14-hydroxy-4,7,10,12,16-docosapentaenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36O3
InChI InChI=1S/C23H36O3/c1-3-4-5-6-13-16-19-22(24)20-17-14-11-9-7-8-10-12-15-18-21-23(25)26-2/h7-8,11-17,20,22,24H,3-6,9-10,18-19,21H2,1-2H3/b8-7-,14-11-,15-12-,16-13-,20-17+
InChIKey KQROFSUVOAKGFX-OPDJUUHMSA-N
Molecular Weight 360.538 g/mol
SMILES OC(\C=C\C=C/C\C=C/C\C=C/CCC(=O)OC)C\C=C/CCCCC
SPLASH splash10-002f-9120000000-a0d57ba58a586afcab2c
Source of Spectrum X2-53-61-4
Wiley ID 1603400