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Ethyl (4E)-2-acetyl-2,4-dimethyl-4-hexenoate
SpectraBase Compound ID GThcEbsCTL2
InChI InChI=1S/C12H20O3/c1-6-9(3)8-12(5,10(4)13)11(14)15-7-2/h6H,7-8H2,1-5H3/b9-6+
InChIKey OFPGNENFBAKLKN-RMKNXTFCSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2oxAE2EEval
Name 4-HEXENOIC ACID, 2-ACETYL-2,4-DIMETHYL-, ETHYL ESTER, trans-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-6-9(3)8-12(5,10(4)13)11(14)15-7-2/h6H,7-8H2,1-5H3/b9-6+
InChIKey OFPGNENFBAKLKN-RMKNXTFCSA-N
Molecular Weight 212.1407
SMILES C\C=C/(C)CC(C(OCC)=O)(C(=O)C)C
SPLASH splash10-0006-9200000000-9ad797392d3b8844c1de
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany