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9,12-Octadecadienoic acid (Z,Z)-, 2,3-bis(acetyloxy)propyl ester
SpectraBase Compound ID 5cR0EBuZtBd
InChI InChI=1S/C25H42O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)30-21-24(31-23(3)27)20-29-22(2)26/h8-9,11-12,24H,4-7,10,13-21H2,1-3H3/b9-8+,12-11+
InChIKey BVIPVQLDRBBSFA-MVKOLZDDSA-N
Mol Weight 438.6 g/mol
Molecular Formula C25H42O6
Exact Mass 438.298139 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BaQ0gwRc0su
Name 9,12-Octadecadienoic acid (Z,Z)-, 2,3-bis(acetyloxy)propyl ester
Alternate Name(s) (9E,12E)-octadeca-9,12-dienoic acid 2,3-diacetoxypropyl ester 2,3-Bis(acetyloxy)propyl (9E,12E)-9,12-octadecadienoate (9E,12E)-octadeca-9,12-dienoic acid 2,3-diacetyloxypropyl ester 2,3-Diacetoxypropyl (9E,12E)-octadeca-9,12-dienoate 2,3-Diacetyloxypropyl (9E,12E)-octadeca-9,12-dienoate
CAS Registry Number 55320-04-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H42O6
InChI InChI=1S/C25H42O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)30-21-24(31-23(3)27)20-29-22(2)26/h8-9,11-12,24H,4-7,10,13-21H2,1-3H3/b9-8+,12-11+
InChIKey BVIPVQLDRBBSFA-MVKOLZDDSA-N
Molecular Weight 438.605 g/mol
SMILES CC(=O)OCC(OC(=O)C)COC(=O)CCCCCCC\C=C\C\C=C\CCCCC
SPLASH splash10-0006-9200000000-b3735603e94c49edee7e
Wiley ID 1472509