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(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-(3-nitrophenyl)methanone
SpectraBase Compound ID ANPTlvKiKrn
InChI InChI=1S/C12H10BrN3O3/c1-7-11(13)8(2)15(14-7)12(17)9-4-3-5-10(6-9)16(18)19/h3-6H,1-2H3
InChIKey DJOPPBUWOFCTTM-UHFFFAOYSA-N
Mol Weight 324.13 g/mol
Molecular Formula C12H10BrN3O3
Exact Mass 322.990554 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KADp8ulHNKo
Name (4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-(3-nitrophenyl)methanone
Alternate Name(s) (4-bromo-3,5-dimethyl-1-pyrazolyl)-(3-nitrophenyl)methanone 4-Bromo-3,5-dimethyl-1-(3-nitrobenzoyl)-1H-pyrazole (4-bromo-3,5-dimethylpyrazol-1-yl)-(3-nitrophenyl)methanone
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Formula C12H10BrN3O3
InChI InChI=1S/C12H10BrN3O3/c1-7-11(13)8(2)15(14-7)12(17)9-4-3-5-10(6-9)16(18)19/h3-6H,1-2H3
InChIKey DJOPPBUWOFCTTM-UHFFFAOYSA-N
Molecular Weight 324.134 g/mol
SMILES c1cc(N(=O)=O)cc(C([n]2nc(C)c(c2C)Br)=O)c1
SPLASH splash10-0udi-7901000000-dc57784daa47eb379bc5
Wiley ID 1511155