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METHYL-(2-E,6-E)-10-OXO-3,7,11-TRI-METHYL-DODECA-2,6-DIENOATE
SpectraBase Compound ID AnpCjmPJ3Wz
InChI InChI=1S/C16H26O3/c1-12(2)15(17)10-9-13(3)7-6-8-14(4)11-16(18)19-5/h7,11-12H,6,8-10H2,1-5H3/b13-7+,14-11+
InChIKey AGGJKAKOYBDZSU-FYCHQBGDSA-N
Mol Weight 266.38 g/mol
Molecular Formula C16H26O3
Exact Mass 266.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4aSC6aoCduy
Name (2E,6E)-10-keto-3,7,11-trimethyl-dodeca-2,6-dienoic acid methyl ester
Classification Sesquiterpenoids
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 266.188194694 u
Formula C16H26O3
InChI InChI=1S/C16H26O3/c1-12(2)15(17)10-9-13(3)7-6-8-14(4)11-16(18)19-5/h7,11-12H,6,8-10H2,1-5H3/b13-7+,14-11+
InChIKey AGGJKAKOYBDZSU-FYCHQBGDSA-N
Molecular Weight 266.381 g/mol
Number of Peaks 14
SMILES C(=O)(OC)\C=C/(C)CC\C=C\(CCC(C(C)C)=O)C
SPLASH splash10-006x-9200000000-87d11ef5df86fb7d59fa
Source of Spectrum FF-19-241-3 (DOI: 10.1002/ffj.1295)
Synonyms (2E,6E)-3,7,11-trimethyl-10-oxododeca-2,6-dienoic acid methyl ester (2E,6E)-Methyl-3,7,11-trimethyl-10-oxododecadienoate Methyl (2E,6E)-3,7,11-trimethyl-10-oxidanylidene-dodeca-2,6-dienoate Methyl (2E,6E)-3,7,11-trimethyl-10-oxo-dodeca-2,6-dienoate (2E,6E)-methyl 3,7,11-trimethyl-10-oxododeca-2,6-dienoate Methyl (2E,6E)-3,7,11-trimethyl-10-oxododeca-2,6-dienoate
Wiley ID 1775355