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rac-Isobutyl 2-acetyl-2-methyl-5-oxohexanoate
SpectraBase Compound ID 798OBvg4NvP
InChI InChI=1S/C13H22O4/c1-9(2)8-17-12(16)13(5,11(4)15)7-6-10(3)14/h9H,6-8H2,1-5H3
InChIKey FCBDXKCBBRAAFX-UHFFFAOYSA-N
Mol Weight 242.31 g/mol
Molecular Formula C13H22O4
Exact Mass 242.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2sj5ASWEWpK
Name rac-Isobutyl 2-acetyl-2-methyl-5-oxohexanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O4
InChI InChI=1S/C13H22O4/c1-9(2)8-17-12(16)13(5,11(4)15)7-6-10(3)14/h9H,6-8H2,1-5H3
InChIKey FCBDXKCBBRAAFX-UHFFFAOYSA-N
Molecular Weight 242.315 g/mol
SMILES C(C(OCC(C)C)=O)(CCC(=O)C)(C(=O)C)C
SPLASH splash10-0002-9220000000-62620b75ccf45de2abca
Source of Spectrum QE-7-1024-5
Synonyms isobutyl 2-acetyl-2-methyl-5-oxohexanoate
Wiley ID 845469