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9,12-Octadecadienoic acid (Z,Z)-, 2-(acetyloxy)-1-[(acetyloxy)methyl]ethyl ester
SpectraBase Compound ID 6iZHwxC9XCs
InChI InChI=1S/C25H42O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)31-24(20-29-22(2)26)21-30-23(3)27/h8-9,11-12,24H,4-7,10,13-21H2,1-3H3/b9-8-,12-11-
InChIKey NZTNNIRJXRULJD-MURFETPASA-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 ETA1u3mTHop
Name 9,12-Octadecadienoic acid (Z,Z)-, 2-(acetyloxy)-1-[(acetyloxy)methyl]ethyl ester
Alternate Name(s) 2-(Acetyloxy)-1-[(acetyloxy)methyl]ethyl (9E,12E)-9,12-octadecadienoate (9Z,12Z)-octadeca-9,12-dienoic acid 1,3-diacetyloxypropan-2-yl ester [2-acetoxy-1-(acetoxymethyl)ethyl] (9Z,12Z)-octadeca-9,12-dienoate 1,3-Diacetyloxypropan-2-yl (9Z,12Z)-octadeca-9,12-dienoate
CAS Registry Number 55320-03-1
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)31-24(20-29-22(2)26)21-30-23(3)27/h8-9,11-12,24H,4-7,10,13-21H2,1-3H3/b9-8-,12-11-
InChIKey NZTNNIRJXRULJD-MURFETPASA-N
Molecular Weight 438.605 g/mol
SMILES CCCCC\C=C/C\C=C/CCCCCCCC(=O)OC(COC(C)=O)COC(C)=O
SPLASH splash10-03di-4911000000-5724e03bc5cbec8a51e0
Source of Spectrum AA-0-2211-1
Wiley ID 1384195