For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-Benzoylacetyl-1-methyl-5-nitroimidazole
SpectraBase Compound ID 3YmeEkAyQoJ
InChI InChI=1S/C13H11N3O4/c1-15-12(16(19)20)8-14-13(15)11(18)7-10(17)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3
InChIKey LPNWFCGXQXEOOD-UHFFFAOYSA-N
Mol Weight 273.25 g/mol
Molecular Formula C13H11N3O4
Exact Mass 273.074956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HZZpJTFwuxQ
Name 2-Benzoylacetyl-1-methyl-5-nitroimidazole
Alternate Name(s) 1-(1-Methyl-5-nitro-1H-imidazol-2-yl)-3-phenyl-1,3-propanedione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11N3O4
InChI InChI=1S/C13H11N3O4/c1-15-12(16(19)20)8-14-13(15)11(18)7-10(17)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3
InChIKey LPNWFCGXQXEOOD-UHFFFAOYSA-N
Molecular Weight 273.248 g/mol
SMILES c1(ncc([n]1C)N(=O)=O)C(=O)CC(c1ccccc1)=O
SPLASH splash10-0zi0-4910000000-140efa9040a8dd4cc34f
Source of Spectrum H1-38-508-4
Wiley ID 756033