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2-Hexanone

View entire compound with spectra: 30 NMR, 8 FTIR, 2 Raman, 32 MS (GC), and 2 Near IR

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)

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SpectraBase Spectrum ID FrcVVuRsCrk
Name 2-HEXANONE
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 100.088815005 u
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
Nominal Mass 100 u
Number of Peaks 24
SMILES CC(=O)CCCC
SPLASH splash10-052f-9000000000-31f107a974f6526289fe
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Wiley ID MVX000294