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Hexanoic acid, 6-[2-(acetyloxy)cyclohexylidene]-2-methyl-3-oxo-, methyl ester
SpectraBase Compound ID 8m7aKoQpl3A
InChI InChI=1S/C16H24O5/c1-11(16(19)20-3)14(18)9-6-8-13-7-4-5-10-15(13)21-12(2)17/h8,11,15H,4-7,9-10H2,1-3H3/b13-8+
InChIKey XLUPZCOXJOFDOY-MDWZMJQESA-N
Mol Weight 296.36 g/mol
Molecular Formula C16H24O5
Exact Mass 296.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LUy6fxGfMV
Name Hexanoic acid, 6-[2-(acetyloxy)cyclohexylidene]-2-methyl-3-oxo-, methyl ester
CAS Registry Number 79707-74-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O5
InChI InChI=1S/C16H24O5/c1-11(16(19)20-3)14(18)9-6-8-13-7-4-5-10-15(13)21-12(2)17/h8,11,15H,4-7,9-10H2,1-3H3/b13-8+
InChIKey XLUPZCOXJOFDOY-MDWZMJQESA-N
Molecular Weight 296.363 g/mol
SMILES C(C(=O)OC)(C(=O)CC\C=C\1C(OC(=O)C)CCCC1)C
SPLASH splash10-05bf-9400000000-00700ae4cc073ee7b0eb
Source of Spectrum C-103-7556-0
Synonyms (E)-2-Acetoxy[4-(carbomethoxy)-3-oxopentyl)methylidene]cyclohexane Methyl (6E)-6-[2-(acetyloxy)cyclohexylidene]-2-methyl-3-oxohexanoate
Wiley ID 1299015