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Ethyl (4E)-2-acetyl-2-methyl-4-hexenoate
SpectraBase Compound ID HL1yMlc0UE1
InChI InChI=1S/C11H18O3/c1-5-7-8-11(4,9(3)12)10(13)14-6-2/h5,7H,6,8H2,1-4H3/b7-5+
InChIKey LQRBFMNUFOTEEW-FNORWQNLSA-N
Mol Weight 198.26 g/mol
Molecular Formula C11H18O3
Exact Mass 198.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C33W2TsXoQ2
Name 4-HEXENOIC ACID, 2-ACETYL-2-METHYL-, ETHYL ESTER, (E)-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H18O3
InChI InChI=1S/C11H18O3/c1-5-7-8-11(4,9(3)12)10(13)14-6-2/h5,7H,6,8H2,1-4H3/b7-5+
InChIKey LQRBFMNUFOTEEW-FNORWQNLSA-N
Molecular Weight 198.1251
SMILES C\C=C\CC(C(OCC)=O)(C(=O)C)C
SPLASH splash10-054o-9400000000-53bdfda3d4f7aea5f105
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany