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[2'-Methyl-1'-(1"-methylethyl)propyl] 3-oxotetradeca-6,8-dienoate
SpectraBase Compound ID 73z7blQKmSJ
InChI InChI=1S/C21H36O3/c1-6-7-8-9-10-11-12-13-14-15-19(22)16-20(23)24-21(17(2)3)18(4)5/h10-13,17-18,21H,6-9,14-16H2,1-5H3/b11-10+,13-12+
InChIKey FZELFHBGQMGAMZ-AQASXUMVSA-N
Mol Weight 336.5 g/mol
Molecular Formula C21H36O3
Exact Mass 336.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2oLFlUqUiIR
Name [2'-Methyl-1'-(1"-methylethyl)propyl] 3-oxotetradeca-6,8-dienoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36O3
InChI InChI=1S/C21H36O3/c1-6-7-8-9-10-11-12-13-14-15-19(22)16-20(23)24-21(17(2)3)18(4)5/h10-13,17-18,21H,6-9,14-16H2,1-5H3/b11-10+,13-12+
InChIKey FZELFHBGQMGAMZ-AQASXUMVSA-N
Molecular Weight 336.516 g/mol
SMILES C(CC(=O)CC\C=C\C=C\CCCCC)(OC(C(C)C)C(C)C)=O
SPLASH splash10-0a4i-9210000000-888546081884f5f8063f
Source of Spectrum H-84-1105-13
Synonyms 1-isopropyl-2-methylpropyl (6E,8E)-3-oxo-6,8-tetradecadienoate [2'-Methyl-1'-(1''-methylethyl)propyl]3-oxotetradeca-6,8-dienoate
Wiley ID 847611