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4,6-Octadienoic acid, 2-acetyl-2-methyl-, ethyl ester
SpectraBase Compound ID 5odWVJJED4z
InChI InChI=1S/C13H20O3/c1-5-7-8-9-10-13(4,11(3)14)12(15)16-6-2/h5,7-9H,6,10H2,1-4H3/b7-5+,9-8+
InChIKey OCDJXTPFLMMWKG-ZIRGRKGMSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hyrd6TE5Ei3
Name 4,6-OCTADIENOIC ACID, 2-ACETYL-2-METHYL-, ETHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-5-7-8-9-10-13(4,11(3)14)12(15)16-6-2/h5,7-9H,6,10H2,1-4H3/b7-5+,9-8+
InChIKey OCDJXTPFLMMWKG-ZIRGRKGMSA-N
Molecular Weight 224.1407
SMILES C\C=C\C=C\CC(C(OCC)=O)(C(=O)C)C
SPLASH splash10-002f-9100000000-f730ee3cb8024909ee7d
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany