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

*Links on SpectraBase are not permalinks.
2-Hexanone
SpectraBase Compound ID 7k7EdY0L2T7
InChI InChI=1S/C6H12O/c1-3-4-5-6(2)7/h3-5H2,1-2H3
InChIKey QQZOPKMRPOGIEB-UHFFFAOYSA-N
Mol Weight 100.16 g/mol
Molecular Formula C6H12O
Exact Mass 100.088815 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 FJn1AO1enrx
Name 2-Hexanone
Alternate Name(s) 2-Hexanone methyl n-butyl ketone 2-Oxohexane Butyl methyl ketone Hexan-2-one Hexanone-2 Ketone, butyl methyl MBK Methyl butyl ketone MNBK n-Butyl methyl ketone N-C4H9COCH3 Propylacetone BRN 1737676 EINECS 209-731-1 HSDB 543
CAS Registry Number 591-78-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12O
InChI InChI=1S/C6H12O/c1-3-4-5-6(2)7/h3-5H2,1-2H3
InChIKey QQZOPKMRPOGIEB-UHFFFAOYSA-N
Molecular Weight 100.161 g/mol
SMILES CC(CCCC)=O
SPLASH splash10-052f-9100000000-e4f28d2bf9d023b0418f
Source of Spectrum O-21-559-4
Wiley ID 1119596