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Hexanoic acid, 2-butyl-3,5-dioxo-, methyl ester
SpectraBase Compound ID 51ohgyZWQGV
InChI InChI=1S/C11H18O4/c1-4-5-6-9(11(14)15-3)10(13)7-8(2)12/h9H,4-7H2,1-3H3
InChIKey ZFZRSJKXRAUWJA-UHFFFAOYSA-N
Mol Weight 214.26 g/mol
Molecular Formula C11H18O4
Exact Mass 214.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LmsxuyarYIx
Name Hexanoic acid, 2-butyl-3,5-dioxo-, methyl ester
Alternate Name(s) Methyl 2-butyl-3,5-dioxohexanoate 2-Butyl-3,5-dioxohexanoic acid methyl ester Methyl 2-butyl-3,5-dioxo-hexanoate Methyl 2-butyl-3,5-bis(oxidanylidene)hexanoate
CAS Registry Number 113618-25-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O4
InChI InChI=1S/C11H18O4/c1-4-5-6-9(11(14)15-3)10(13)7-8(2)12/h9H,4-7H2,1-3H3
InChIKey ZFZRSJKXRAUWJA-UHFFFAOYSA-N
Molecular Weight 214.261 g/mol
SMILES C(C(CC(=O)C)=O)(C(=O)OC)CCCC
SPLASH splash10-000f-9010000000-a1580082a589080d053d
Source of Spectrum F-46-2042-6
Wiley ID 1213370