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1-(2,4-Dinitrophenyl)-3-(4-chlorophenyl)-5-methyl-1,2,4-triazole

View entire compound with spectra: 1 NMR

1-(2,4-Dinitrophenyl)-3-(4-chlorophenyl)-5-methyl-1,2,4-triazole
SpectraBase Compound ID 6X60yuvuPsC
InChI InChI=1S/C15H10ClN5O4/c1-9-17-15(10-2-4-11(16)5-3-10)18-19(9)13-7-6-12(20(22)23)8-14(13)21(24)25/h2-8H,1H3
InChIKey MFZRHDZGIPDONP-UHFFFAOYSA-N
Mol Weight 359.73 g/mol
Molecular Formula C15H10ClN5O4
Exact Mass 359.042132 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D9mf891zLas
Name 1-(2,4-Dinitrophenyl)-3-(4-chlorophenyl)-5-methyl-1,2,4-triazole
Comments Computed using HOSE algorithm
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Exact Mass 359.042131518 u
Formula C15H10ClN5O4
InChI InChI=1S/C15H10ClN5O4/c1-9-17-15(10-2-4-11(16)5-3-10)18-19(9)13-7-6-12(20(22)23)8-14(13)21(24)25/h2-8H,1H3
InChIKey MFZRHDZGIPDONP-UHFFFAOYSA-N
Molecular Weight 359.729 g/mol
SMILES CC=1N(N=C(C2=CC=C(C=C2)Cl)N1)C1=CC=C(C=C1N(=O)=O)N(=O)=O