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Hexanoic acid, 2-isopropyl-2-methyl-5-oxo-, methyl ester
SpectraBase Compound ID BQHdUDPQpyz
InChI InChI=1S/C11H20O3/c1-8(2)11(4,10(13)14-5)7-6-9(3)12/h8H,6-7H2,1-5H3
InChIKey ZIIWTDYBBHQCLS-UHFFFAOYSA-N
Mol Weight 200.28 g/mol
Molecular Formula C11H20O3
Exact Mass 200.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HUGrunWHLx8
Name Hexanoic acid, 2-isopropyl-2-methyl-5-oxo-, methyl ester
Alternate Name(s) Methyl 2-isopropyl-2-methyl-5-oxohexanoate 2-isopropyl-5-keto-2-methyl-hexanoic acid methyl ester 2-Methyl-5-oxo-2-propan-2-ylhexanoic acid methyl ester Methyl 2-methyl-5-oxidanylidene-2-propan-2-yl-hexanoate Methyl 2-methyl-5-oxo-2-propan-2-ylhexanoate
CAS Registry Number 33422-34-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O3
InChI InChI=1S/C11H20O3/c1-8(2)11(4,10(13)14-5)7-6-9(3)12/h8H,6-7H2,1-5H3
InChIKey ZIIWTDYBBHQCLS-UHFFFAOYSA-N
Molecular Weight 200.278 g/mol
SMILES CC(=O)CCC(C)(C(C)C)C(=O)OC
SPLASH splash10-0006-9200000000-599c632de81176a8e9c2
Source of Spectrum A-2-175-1
Wiley ID 1197698