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Propanoic acid, 2-methyl-, 2-methylbutyl ester
SpectraBase Compound ID FbM1hwATHl3
InChI InChI=1S/C9H18O2/c1-5-8(4)6-11-9(10)7(2)3/h7-8H,5-6H2,1-4H3
InChIKey DUAXUBMIVRZGCO-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 8DTRggmoOxO
Name Propanoic acid, 2-methyl-, 2-methylbutyl ester
CAS Registry Number 2445-69-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18O2
InChI InChI=1S/C9H18O2/c1-5-8(4)6-11-9(10)7(2)3/h7-8H,5-6H2,1-4H3
InChIKey DUAXUBMIVRZGCO-UHFFFAOYSA-N
Molecular Weight 158.241 g/mol
SMILES CCC(COC(=O)C(C)C)C
SPLASH splash10-00dl-9000000000-a8b07daea9c6e1727556
Source of Spectrum LQ-1992-3249-0
Synonyms 2-Methylbutyl 2-methylpropanoate 2-Methylbutyl 2-methylpropionate 2-Methylbutyl isobutyrate 2-Methylpropanoic acid 2-methylbutyl ester 2-Methylpropionic acid 2-methylbutyl ester Isobutyric acid, 2-methylbutyl ester AI3-06019 EINECS 219-493-0
Wiley ID 1155481