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1-(4,5-dimethylimidazol-1-yl)-2-phenylethanone
SpectraBase Compound ID L83S3Xm06bK
InChI InChI=1S/C13H14N2O/c1-10-11(2)15(9-14-10)13(16)8-12-6-4-3-5-7-12/h3-7,9H,8H2,1-2H3
InChIKey LCUMQSDZGKKLEM-UHFFFAOYSA-N
Mol Weight 214.27 g/mol
Molecular Formula C13H14N2O
Exact Mass 214.110613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CkjJa2Pu9Ib
Name 1-(4,5-dimethyl-1-imidazolyl)-2-phenylethanone
Alternate Name(s) 1-(4,5-dimethylimidazol-1-yl)-2-phenyl-ethanone
CAS Registry Number 123331-36-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O
InChI InChI=1S/C13H14N2O/c1-10-11(2)15(9-14-10)13(16)8-12-6-4-3-5-7-12/h3-7,9H,8H2,1-2H3
InChIKey LCUMQSDZGKKLEM-UHFFFAOYSA-N
Molecular Weight 214.268 g/mol
SMILES c1[n](c(c(n1)C)C)C(Cc1ccccc1)=O
SPLASH splash10-0005-9000000000-c62ef88a7e9bd02961d7
Source of Spectrum K-123-334-1
Wiley ID 1213796