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2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl 3-fluorobenzoate
SpectraBase Compound ID 8LyzQF7Z56m
InChI InChI=1S/C13H12FN3O4/c1-9-15-8-12(17(19)20)16(9)5-6-21-13(18)10-3-2-4-11(14)7-10/h2-4,7-8H,5-6H2,1H3
InChIKey ISSPMVFGTDUVRU-UHFFFAOYSA-N
Mol Weight 293.25 g/mol
Molecular Formula C13H12FN3O4
Exact Mass 293.081184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GjtzQcMObbk
Name 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl 3-fluorobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12FN3O4
InChI InChI=1S/C13H12FN3O4/c1-9-15-8-12(17(19)20)16(9)5-6-21-13(18)10-3-2-4-11(14)7-10/h2-4,7-8H,5-6H2,1H3
InChIKey ISSPMVFGTDUVRU-UHFFFAOYSA-N
Molecular Weight 293.254 g/mol
SMILES c1(cc(ccc1)F)C(OCC[n]1c([N+](=O)[O-])cnc1C)=O
SPLASH splash10-00xs-5930000000-8f7435a6ff0ba04fe305
Source of Spectrum Uzma Salar, et al. European Journal of Medicinal Chemistry, V.125, 2017, P.1289-1299
Wiley ID 1816761