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2-Methyl-propionic acid, octyl ester
SpectraBase Compound ID HC5ESZaitH2
InChI InChI=1S/C12H24O2/c1-4-5-6-7-8-9-10-14-12(13)11(2)3/h11H,4-10H2,1-3H3
InChIKey PQCYCHFQWMNQRJ-UHFFFAOYSA-N
Mol Weight 200.32 g/mol
Molecular Formula C12H24O2
Exact Mass 200.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7k4shbdXnDh
Name Propanoic acid, 2-methyl-, octyl ester
Alternate Name(s) 2-Methylpropanoic acid octyl ester Octyl 2-methylpropanoate 2-Methylpropionic acid octyl ester Acetyl 2-methylpropanoate Caprylyl isobutyrate Isobutyric acid, octyl ester n-Octyl iso-butyrate Octyl Isobutyrate Propanoic acid, 2-methyl-, acetyl ester AI3-24265 EINECS 203-651-0 ENT 24265 FEMA NO. 2808 NSC 72024
CAS Registry Number 109-15-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H24O2
InChI InChI=1S/C12H24O2/c1-4-5-6-7-8-9-10-14-12(13)11(2)3/h11H,4-10H2,1-3H3
InChIKey PQCYCHFQWMNQRJ-UHFFFAOYSA-N
Molecular Weight 200.322 g/mol
SMILES C(=O)(C(C)C)OCCCCCCCC
SPLASH splash10-052f-9000000000-41ca8c813ec55d365861
Source of Spectrum MG-141-0-0
Wiley ID 1198011