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1-Methyl-4-nitro-5-(4-nitro-phenoxy)-1H-imidazole
SpectraBase Compound ID KLZmCnFbxYf
InChI InChI=1S/C10H8N4O5/c1-12-6-11-9(14(17)18)10(12)19-8-4-2-7(3-5-8)13(15)16/h2-6H,1H3
InChIKey VZCMPXFZYLLPKI-UHFFFAOYSA-N
Mol Weight 264.2 g/mol
Molecular Formula C10H8N4O5
Exact Mass 264.049469 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LY2DchjUDTf
Name 1-Methyl-4-nitro-5-(4-nitro-phenoxy)-1H-imidazole
Comments Computed using HOSE algorithm
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Exact Mass 264.049469369 u
Formula C10H8N4O5
InChI InChI=1S/C10H8N4O5/c1-12-6-11-9(14(17)18)10(12)19-8-4-2-7(3-5-8)13(15)16/h2-6H,1H3
InChIKey VZCMPXFZYLLPKI-UHFFFAOYSA-N
Molecular Weight 264.197 g/mol
SMILES C1(=C(N(C)C=N1)OC=1C=CC(N(=O)=O)=CC1)N(=O)=O