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methyl 2-methylimidazol-5-yl ketone

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

methyl 2-methylimidazol-5-yl ketone
SpectraBase Compound ID 6xvNhYhejyR
InChI InChI=1S/C6H8N2O/c1-4(9)6-3-7-5(2)8-6/h3H,1-2H3,(H,7,8)
InChIKey MZJZNADJWQEIIG-UHFFFAOYSA-N
Mol Weight 124.14 g/mol
Molecular Formula C6H8N2O
Exact Mass 124.063663 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FTIaOI9N0UL
Name 1-(2-Methyl-1H-imidazol-4-yl)ethanone
Alternate Name(s) 1-(2-Methyl-1H-imidazol-5-yl)ethanone 4-Acetyl-2-methylimidazole
CAS Registry Number 78210-66-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H8N2O
InChI InChI=1S/C6H8N2O/c1-4(9)6-3-7-5(2)8-6/h3H,1-2H3,(H,7,8)
InChIKey MZJZNADJWQEIIG-UHFFFAOYSA-N
Molecular Weight 124.143 g/mol
SMILES [nH]1cc(nc1C)C(=O)C
SPLASH splash10-0pc0-9800000000-0be52393229cab081892
Source of Spectrum J-52-2721-4
Wiley ID 1128682