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Hexanoic acid ethyl ester

View entire compound with spectra: 6 NMR, 14 FTIR, 2 Raman, 32 MS (GC), and 2 Near IR

Hexanoic acid ethyl ester
SpectraBase Compound ID mbtA9bTnjR
InChI InChI=1S/C8H16O2/c1-3-5-6-7-8(9)10-4-2/h3-7H2,1-2H3
InChIKey SHZIWNPUGXLXDT-UHFFFAOYSA-N
Mol Weight 144.21 g/mol
Molecular Formula C8H16O2
Exact Mass 144.11503 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9V0TwgFik1f
Name Ethyl hexanoate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 148962
CAS Registry Number 123-66-0
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16O2
InChI InChI=1S/C8H16O2/c1-3-5-6-7-8(9)10-4-2/h3-7H2,1-2H3
InChIKey SHZIWNPUGXLXDT-UHFFFAOYSA-N
Observed nucleus 13C
Purity >=99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms Caproic acid ethyl ester Ethyl caproate
Wiley ID SIAL_13CNMR_001455