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Propionic acid, octyl ester

View entire compound with spectra: 8 NMR, 4 FTIR, and 6 MS (GC)

Propionic acid, octyl ester
SpectraBase Compound ID Iu8kgO5AVsz
InChI InChI=1S/C11H22O2/c1-3-5-6-7-8-9-10-13-11(12)4-2/h3-10H2,1-2H3
InChIKey CEQGYPPMTKWBIU-UHFFFAOYSA-N
Mol Weight 186.29 g/mol
Molecular Formula C11H22O2
Exact Mass 186.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ZkzIdyRCS
Name Propanoic acid, octyl ester
CAS Registry Number 142-60-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O2
InChI InChI=1S/C11H22O2/c1-3-5-6-7-8-9-10-13-11(12)4-2/h3-10H2,1-2H3
InChIKey CEQGYPPMTKWBIU-UHFFFAOYSA-N
Molecular Weight 186.295 g/mol
SMILES CCCCCCCCOC(=O)CC
SPLASH splash10-056u-9000000000-348bb59ff4c5b77df079
Synonyms n-Octyl propanoate n-Octyl propionate Octyl propionate Octyl propanoate Nor-octyl propionate Propionic acid octyl ester Propionic acid, octyl ester Propanoic acid octyl ester AI3-33596 EINECS 205-548-6 FEMA NO. 2813
Wiley ID 1492707