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4-Methyl-2-pentanone

View entire compound with spectra: 39 NMR, 24 FTIR, 2 Raman, 36 MS (GC), and 2 Near IR

4-Methyl-2-pentanone
SpectraBase Compound ID 99jAXE64w6k
InChI InChI=1S/C6H12O/c1-5(2)4-6(3)7/h5H,4H2,1-3H3
InChIKey NTIZESTWPVYFNL-UHFFFAOYSA-N
Mol Weight 100.16 g/mol
Molecular Formula C6H12O
Exact Mass 100.088815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KPSTsleRrKi
Name ISOBUTYL-METHYL-KETONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H12O
InChI InChI=1S/C6H12O/c1-5(2)4-6(3)7/h5H,4H2,1-3H3
InChIKey NTIZESTWPVYFNL-UHFFFAOYSA-N
Literature Reference Author I.C.JONES,G.J.SHARMAN,J.PIDGEON
Literature Reference Citation MAGN.RES.CHEM.,43,497(2005)
Literature Reference DOI 10.1002/mrc.1578
Molecular Weight 100.161 g/mol
Solvent CD3OD
Source File Reference UWLU36244