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Nonanoic acid, 9-oxo-, 1-methylethyl ester
SpectraBase Compound ID B6NKU61XNsA
InChI InChI=1S/C12H22O3/c1-11(2)15-12(14)9-7-5-3-4-6-8-10-13/h10-11H,3-9H2,1-2H3
InChIKey JJQQFLZQYQZQHF-UHFFFAOYSA-N
Mol Weight 214.3 g/mol
Molecular Formula C12H22O3
Exact Mass 214.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K0dBYCNsS8a
Name Nonanoic acid, 9-oxo-, 1-methylethyl ester
Alternate Name(s) Isopropyl 9-oxononanoate 9-ketopelargonic acid isopropyl ester 9-Oxononanoic acid propan-2-yl ester Propan-2-yl 9-oxidanylidenenonanoate Propan-2-yl 9-oxononanoate
CAS Registry Number 34208-02-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O3
InChI InChI=1S/C12H22O3/c1-11(2)15-12(14)9-7-5-3-4-6-8-10-13/h10-11H,3-9H2,1-2H3
InChIKey JJQQFLZQYQZQHF-UHFFFAOYSA-N
Molecular Weight 214.305 g/mol
SMILES C(=O)CCCCCCCC(=O)OC(C)C
SPLASH splash10-0a4l-9400000000-2f499a61e9500de623c8
Wiley ID 1469409