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4(5)-(4-Toluoyl)imidazole

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

4(5)-(4-Toluoyl)imidazole
SpectraBase Compound ID LgGbfwLHVX4
InChI InChI=1S/C11H10N2O/c1-8-2-4-9(5-3-8)11(14)10-6-12-7-13-10/h2-7H,1H3,(H,12,13)
InChIKey JJACNNVFZULNKR-UHFFFAOYSA-N
Mol Weight 186.21 g/mol
Molecular Formula C11H10N2O
Exact Mass 186.079313 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3NOqluR1DuT
Name 1H-imidazol-5-yl(p-tolyl)methanone
Alternate Name(s) 1H-imidazol-5-yl-(4-methylphenyl)methanone
CAS Registry Number 78892-77-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10N2O
InChI InChI=1S/C11H10N2O/c1-8-2-4-9(5-3-8)11(14)10-6-12-7-13-10/h2-7H,1H3,(H,12,13)
InChIKey JJACNNVFZULNKR-UHFFFAOYSA-N
Molecular Weight 186.214 g/mol
SMILES [nH]1cnc(c1)C(c1ccc(cc1)C)=O
SPLASH splash10-014u-5900000000-51ec226a4b582b901960
Source of Spectrum KC-1989-1144-19
Wiley ID 1183009