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Methyl 1-(2-bromobenzyl)-3-methyl-1H-pyrazole-4-carboxylate

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Methyl 1-(2-bromobenzyl)-3-methyl-1H-pyrazole-4-carboxylate
SpectraBase Compound ID 6ghIHIHKHLu
InChI InChI=1S/C13H13BrN2O2/c1-9-11(13(17)18-2)8-16(15-9)7-10-5-3-4-6-12(10)14/h3-6,8H,7H2,1-2H3
InChIKey TXTGRDBAEKQMEK-UHFFFAOYSA-N
Mol Weight 309.16 g/mol
Molecular Formula C13H13BrN2O2
Exact Mass 308.016041 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7anPqszyvFR
Name Methyl 1-(2-bromobenzyl)-3-methyl-1H-pyrazole-4-carboxylate
Alternate Name(s) 1-[(2-bromophenyl)methyl]-3-methyl-4-pyrazolecarboxylic acid methyl ester Methyl 1-[(2-bromophenyl)methyl]-3-methylpyrazole-4-carboxylate Methyl 1-[(2-bromophenyl)methyl]-3-methyl-pyrazole-4-carboxylate
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Formula C13H13BrN2O2
InChI InChI=1S/C13H13BrN2O2/c1-9-11(13(17)18-2)8-16(15-9)7-10-5-3-4-6-12(10)14/h3-6,8H,7H2,1-2H3
InChIKey TXTGRDBAEKQMEK-UHFFFAOYSA-N
Molecular Weight 309.163 g/mol
SMILES c1(n[n](cc1C(=O)OC)Cc1c(cccc1)Br)C
SPLASH splash10-004i-0290000000-6e3b0ec8dff1e2dc3bc2
Source of Spectrum ASC-352-2041/SM12-1k
Wiley ID 1763953