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Propanoic acid, 2-methyl-, 1-methylbutyl ester
SpectraBase Compound ID F6vEnftLcQ8
InChI InChI=1S/C9H18O2/c1-5-6-8(4)11-9(10)7(2)3/h7-8H,5-6H2,1-4H3
InChIKey DUNWRGFRZIHKPT-UHFFFAOYSA-N
Mol Weight 158.24 g/mol
Molecular Formula C9H18O2
Exact Mass 158.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ic8Xdmh5us
Name Propanoic acid, 2-methyl-, 1-methylbutyl ester
Alternate Name(s) 1-Methylbutyl 2-methylpropanoate .alpha.-Methylbutyl isobutyrate 2-Methylpropanoic acid pentan-2-yl ester 1-Methylbutyl isobutyrate 2-Methylpropionic acid 1-methylbutyl ester Pentan-2-yl 2-methylpropanoate 2-Pentyl 2-methylpropanoate Pentan-2-yl isobutyrate
CAS Registry Number 54340-93-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18O2
InChI InChI=1S/C9H18O2/c1-5-6-8(4)11-9(10)7(2)3/h7-8H,5-6H2,1-4H3
InChIKey DUNWRGFRZIHKPT-UHFFFAOYSA-N
Molecular Weight 158.241 g/mol
SMILES C(OC(C(C)C)=O)(CCC)C
SPLASH splash10-006x-9000000000-9a69773a6492aa3d6773
Source of Spectrum NW-1992-0-0
Wiley ID 1155466