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

*Links on SpectraBase are not permalinks.
3-Octanone
SpectraBase Compound ID 10QFzfVJd3P
InChI InChI=1S/C8H16O/c1-3-5-6-7-8(9)4-2/h3-7H2,1-2H3
InChIKey RHLVCLIPMVJYKS-UHFFFAOYSA-N
Mol Weight 128.21 g/mol
Molecular Formula C8H16O
Exact Mass 128.120115 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 E32ADstseXc
Name octan-3-one
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 128.120115134 u
Formula C8H16O
GC Column Agilent 190915-433UI (30 m x 250 microm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 320oC
InChI InChI=1S/C8H16O/c1-3-5-6-7-8(9)4-2/h3-7H2,1-2H3
InChIKey RHLVCLIPMVJYKS-UHFFFAOYSA-N
Instrument Name Agilent 8890-5977B
Ionization Type EI
Literature Reference DOI 10.1002/chem.202202212
Molecular Weight 128.215 g/mol
Quality 160
SMILES CCC(CCCCC)=O
SPLASH splash10-0a4i-9000000000-f29f5add2656bb9adca6
Source of Spectrum QE-28-SM96-3aa (DOI: 10.1002/chem.202202212)
Thin-Layer Chromatography 0.47 (nHex/Et2O, 30:1)
Wiley ID 1902370