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4,4-Dibromo-1-(3-methylphenyl)-3-phenyl-2-pyrazolin-5-one

View entire compound with spectra: 1 MS (GC)

4,4-Dibromo-1-(3-methylphenyl)-3-phenyl-2-pyrazolin-5-one
SpectraBase Compound ID 1cV0kUOEguY
InChI InChI=1S/C16H12Br2N2O/c1-11-6-5-9-13(10-11)20-15(21)16(17,18)14(19-20)12-7-3-2-4-8-12/h2-10H,1H3
InChIKey AQDVWXLGMRLENP-UHFFFAOYSA-N
Mol Weight 408.09 g/mol
Molecular Formula C16H12Br2N2O
Exact Mass 405.931639 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BsnR1P1a40j
Name 4,4-Dibromo-1-(3-methylphenyl)-3-phenyl-2-pyrazolin-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12Br2N2O
InChI InChI=1S/C16H12Br2N2O/c1-11-6-5-9-13(10-11)20-15(21)16(17,18)14(19-20)12-7-3-2-4-8-12/h2-10H,1H3
InChIKey AQDVWXLGMRLENP-UHFFFAOYSA-N
Molecular Weight 408.093 g/mol
SMILES C1(C(N(c2cc(ccc2)C)N=C1c1ccccc1)=O)(Br)Br
SPLASH splash10-004m-9545100000-c4eda9d66b740d4ae680
Source of Spectrum F-65-9596-5e
Wiley ID 1678834