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2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl 3-chlorobenzoate
SpectraBase Compound ID JDctoI3wo8O
InChI InChI=1S/C13H12ClN3O4/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 HKNKOUDLYNXHDQ-UHFFFAOYSA-N
Mol Weight 309.71 g/mol
Molecular Formula C13H12ClN3O4
Exact Mass 309.051634 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DrJ96eEcmOg
Name 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl 3-chlorobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12ClN3O4
InChI InChI=1S/C13H12ClN3O4/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 HKNKOUDLYNXHDQ-UHFFFAOYSA-N
Molecular Weight 309.709 g/mol
SMILES c1(cc(ccc1)Cl)C(OCC[n]1c([N+](=O)[O-])cnc1C)=O
SPLASH splash10-000i-1910000000-ee9db9cabd96ff1d6bca
Source of Spectrum Uzma Salar, et al. European Journal of Medicinal Chemistry, V.125, 2017, P.1289-1299
Wiley ID 1816757