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Heptanoic acid, heptyl ester
SpectraBase Compound ID AVLYM3wmasq
InChI InChI=1S/C14H28O2/c1-3-5-7-9-11-13-16-14(15)12-10-8-6-4-2/h3-13H2,1-2H3
InChIKey QOIIBPAJVWFEPE-UHFFFAOYSA-N
Mol Weight 228.38 g/mol
Molecular Formula C14H28O2
Exact Mass 228.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LMFcTMZW1Mb
Name Heptyl heptanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H28O2
InChI InChI=1S/C14H28O2/c1-3-5-7-9-11-13-16-14(15)12-10-8-6-4-2/h3-13H2,1-2H3
InChIKey QOIIBPAJVWFEPE-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 228.376 g/mol
SMILES CCCCCCCOC(=O)CCCCCC
SPLASH splash10-0a4l-9100000000-a7738627837f6b952746
Source of Spectrum SRH-2022-6425-0
Wiley ID 1828255