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4-(4-Chlorophenyl)-3-chloro-1-methyl-5-oxo-1H-4,5-dihydro-1,2,4-triazole
SpectraBase Compound ID GBjBzl6QBfF
InChI InChI=1S/C9H7Cl2N3O/c1-13-9(15)14(8(11)12-13)7-4-2-6(10)3-5-7/h2-5H,1H3
InChIKey ZJMRPDPWFOYIGV-UHFFFAOYSA-N
Mol Weight 244.08 g/mol
Molecular Formula C9H7Cl2N3O
Exact Mass 242.996617 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eegc2kssqE6
Name 4-(4-Chlorophenyl)-3-chloro-1-methyl-5-oxo-1H-4,5-dihydro-1,2,4-triazole
Alternate Name(s) 5-Chloro-4-(4-chlorophenyl)-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one 5-Chloranyl-4-(4-chlorophenyl)-2-methyl-1,2,4-triazol-3-one
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Formula C9H7Cl2N3O
InChI InChI=1S/C9H7Cl2N3O/c1-13-9(15)14(8(11)12-13)7-4-2-6(10)3-5-7/h2-5H,1H3
InChIKey ZJMRPDPWFOYIGV-UHFFFAOYSA-N
Molecular Weight 244.081 g/mol
SMILES C1(=NN(C(N1c1ccc(cc1)Cl)=O)C)Cl
SPLASH splash10-006x-5970000000-d57665be50c3582710b2
Source of Spectrum SO-0-925-13
Wiley ID 1541127