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1H-pyrazolo[5,1-c]-1,2,4-triazole, 7-chloro-6-methyl-3-[3-(4-nitrophenyl)propyl]-
SpectraBase Compound ID J1x12UBJzTS
InChI InChI=1S/C14H14ClN5O2/c1-9-13(15)14-17-16-12(19(14)18-9)4-2-3-10-5-7-11(8-6-10)20(21)22/h5-8,17H,2-4H2,1H3
InChIKey PLDCYIHWBUUACV-UHFFFAOYSA-N
Mol Weight 319.75 g/mol
Molecular Formula C14H14ClN5O2
Exact Mass 319.083602 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8GX8RKbOZb3
Name 1H-pyrazolo[5,1-c]-1,2,4-triazole, 7-chloro-6-methyl-3-[3-(4-nitrophenyl)propyl]-
Alternate Name(s) 7-Chloro-6-methyl-3-(3-(4-nitrophenyl)propyl)-1H-pyrazolo[5,1-c][1,2,4]triazole 7-Chloro-6-methyl-3-[3-(4-nitrophenyl)propyl]-1H-pyrazolo[5,1-c][1,2,4]triazole
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Formula C14H14ClN5O2
InChI InChI=1S/C14H14ClN5O2/c1-9-13(15)14-17-16-12(19(14)18-9)4-2-3-10-5-7-11(8-6-10)20(21)22/h5-8,17H,2-4H2,1H3
InChIKey PLDCYIHWBUUACV-UHFFFAOYSA-N
Molecular Weight 319.752 g/mol
SMILES N1c2c(c(n[n]2C(=N1)CCCc1ccc(cc1)[N+]([O-])=O)C)Cl
SPLASH splash10-00di-3901000000-2548ffc384d2e7499d17
Source of Spectrum JX-2015-3-217
Wiley ID 1723799