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(S)-5-(3-Bromophenyl)-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazole
SpectraBase Compound ID 5kfXQwTxs06
InChI InChI=1S/C16H15BrN2/c1-12-10-16(13-6-5-7-14(17)11-13)19(18-12)15-8-3-2-4-9-15/h2-9,11,16H,10H2,1H3/t16-/m0/s1
InChIKey BRPYXRXPUKXGCS-INIZCTEOSA-N
Mol Weight 315.21 g/mol
Molecular Formula C16H15BrN2
Exact Mass 314.041861 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hio1bWT1uOg
Name (S)-5-(3-Bromophenyl)-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazole
Comments Less than 3 mono-isotopic peaks
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Formula C16H15BrN2
InChI InChI=1S/C16H15BrN2/c1-12-10-16(13-6-5-7-14(17)11-13)19(18-12)15-8-3-2-4-9-15/h2-9,11,16H,10H2,1H3/t16-/m0/s1
InChIKey BRPYXRXPUKXGCS-INIZCTEOSA-N
Molecular Weight 315.214 g/mol
SMILES C1(=NN([C@@](C1)(c1cc(Br)ccc1)[H])c1ccccc1)C
SPLASH splash10-0cdi-0609000000-cbdcd4b6cdbba76f2a76
Source of Spectrum F4-42-2175-2c
Wiley ID 1673949