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(6E,10E)-3-keto-7,11,15-trimethyl-hexadeca-6,10,14-trienoic acid methyl ester
SpectraBase Compound ID 9CkNdXa0IPH
InChI InChI=1S/C20H32O3/c1-16(2)9-6-10-17(3)11-7-12-18(4)13-8-14-19(21)15-20(22)23-5/h9,11,13H,6-8,10,12,14-15H2,1-5H3/b17-11+,18-13+
InChIKey QSYKDUWCAHRZCC-OUBUNXTGSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KifiLsnN2to
Name (6E,10E)-3-keto-7,11,15-trimethyl-hexadeca-6,10,14-trienoic acid methyl ester
CAS Registry Number 111074-87-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-16(2)9-6-10-17(3)11-7-12-18(4)13-8-14-19(21)15-20(22)23-5/h9,11,13H,6-8,10,12,14-15H2,1-5H3/b17-11+,18-13+
InChIKey QSYKDUWCAHRZCC-OUBUNXTGSA-N
Molecular Weight 320.473 g/mol
SMILES C(C(=O)OC)C(=O)CC\C=C\(CC\C=C\(CCC=C(C)C)C)C
SPLASH splash10-0a4r-0900000000-1e4cf1dfa80a0da7bede
Source of Spectrum KC-1986-1573-25
Synonyms (6E,10E)-7,11,15-trimethyl-3-oxohexadeca-6,10,14-trienoic acid methyl ester Methyl (6E,10E)-7,11,15-trimethyl-3-oxidanylidene-hexadeca-6,10,14-trienoate Methyl (6E,10E)-7,11,15-trimethyl-3-oxo-hexadeca-6,10,14-trienoate
Wiley ID 1320449