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2,6-Octadienedioic acid, 2-(4,8-dimethyl-9-oxo-3,7-nonadienyl)-6-methyl-, dimethyl ester, (E,Z,E,Z)-
SpectraBase Compound ID HqkejTJEzOh
InChI InChI=1S/C22H32O5/c1-17(9-6-12-19(3)16-23)10-7-13-20(22(25)27-5)14-8-11-18(2)15-21(24)26-4/h10,12,14-16H,6-9,11,13H2,1-5H3/b17-10+,18-15-,19-12-,20-14+
InChIKey ZWDUXCJMKYCTHQ-HMAJNTFDSA-N
Mol Weight 376.5 g/mol
Molecular Formula C22H32O5
Exact Mass 376.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1Z4FfLbvig
Name 2,6-Octadienedioic acid, 2-(4,8-dimethyl-9-oxo-3,7-nonadienyl)-6-methyl-, dimethyl ester, (E,Z,E,Z)-
CAS Registry Number 79579-47-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O5
InChI InChI=1S/C22H32O5/c1-17(9-6-12-19(3)16-23)10-7-13-20(22(25)27-5)14-8-11-18(2)15-21(24)26-4/h10,12,14-16H,6-9,11,13H2,1-5H3/b17-10+,18-15-,19-12-,20-14+
InChIKey ZWDUXCJMKYCTHQ-HMAJNTFDSA-N
Molecular Weight 376.493 g/mol
SMILES C(\C(=C\CC\C(=C/C(=O)OC)C)CC\C=C\(CC\C=C/(C=O)C)C)(=O)OC
SPLASH splash10-0w59-0490000000-13978353b4db14a7aef3
Source of Spectrum B-34-1498-0
Synonyms Dimethyl (2E,6Z)-2-[(3E,7Z)-4,8-dimethyl-9-oxo-3,7-nonadienyl]-6-methyl-2,6-octadienedioate Dimethyl(2E,6Z)-2-[(3'Z,7'E)-8'-formyl-4',8'-dimethylnona-3',7'-dienyl]-6-methylocta-2,6-dienedioate
Wiley ID 1357859