For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Methyl nonanoate
SpectraBase Compound ID LmEZjSgcErz
InChI InChI=1S/C10H20O2/c1-3-4-5-6-7-8-9-10(11)12-2/h3-9H2,1-2H3
InChIKey IJXHLVMUNBOGRR-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C10H20O2
Exact Mass 172.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1qELxI2INs
Name Methyl nonanoate
CAS Registry Number 1731-84-6
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 172.146329882 u
Formula C10H20O2
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C10H20O2/c1-3-4-5-6-7-8-9-10(11)12-2/h3-9H2,1-2H3
InChIKey IJXHLVMUNBOGRR-UHFFFAOYSA-N
Molecular Weight 172.268 g/mol
Nominal Mass 172 u
Number of Peaks 107
SMILES COC(=O)CCCCCCCC
SPLASH splash10-05fu-9000000000-33fd1ea4a2c054a14c64
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001892