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Methyl hexanoate

View entire compound with spectra: 71 NMR, 11 FTIR, 1 Raman, 50 MS (GC), and 2 Near IR

Methyl hexanoate
SpectraBase Compound ID BNGYVwPw12C
InChI InChI=1S/C7H14O2/c1-3-4-5-6-7(8)9-2/h3-6H2,1-2H3
InChIKey NUKZAGXMHTUAFE-UHFFFAOYSA-N
Mol Weight 130.19 g/mol
Molecular Formula C7H14O2
Exact Mass 130.09938 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GY7ncH73yV8
Name Methyl hexanoate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 259942
CAS Registry Number 106-70-7
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H14O2
InChI 1S/C7H14O2/c1-3-4-5-6-7(8)9-2/h3-6H2,1-2H3
InChIKey NUKZAGXMHTUAFE-UHFFFAOYSA-N
Observed nucleus 13C
Purity 99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms Caproic acid methyl ester; Methyl caproate
Wiley ID SIAL_13CNMR_004615