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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 Bd9SkkOBINb
Name 4-METHYL-2-PENTANONE,(ISOBUTYLMETHYLKETONE)
CAS Registry Number 108-10-1
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 M.J.LOOTS,L.R.WEINGARTEN,R.H.LEVIN
Literature Reference Citation J.AM.CHEM.SOC.,98,4571(1976)
Literature Reference DOI 10.1021/ja00431a040
Molecular Weight 100.161 g/mol
Solvent Unknown
Source File Reference UNIW8746