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4-Bromo-3-(4-chlorophenyl)-1-methyl-5-propyl-1H-pyrazole

View entire compound with spectra: 1 MS (GC)

4-Bromo-3-(4-chlorophenyl)-1-methyl-5-propyl-1H-pyrazole
SpectraBase Compound ID HFfYZ1LsAip
InChI InChI=1S/C13H14BrClN2/c1-3-4-11-12(14)13(16-17(11)2)9-5-7-10(15)8-6-9/h5-8H,3-4H2,1-2H3
InChIKey WIRPIWVWRZOBCG-UHFFFAOYSA-N
Mol Weight 313.63 g/mol
Molecular Formula C13H14BrClN2
Exact Mass 312.002889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IXNDBbbGyLy
Name 4-Bromo-3-(4-chlorophenyl)-1-methyl-5-propyl-1H-pyrazole
Alternate Name(s) 4-Bromo-3-(4-chlorophenyl)-1-methyl-5-propylpyrazole 4-Bromanyl-3-(4-chlorophenyl)-1-methyl-5-propyl-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14BrClN2
InChI InChI=1S/C13H14BrClN2/c1-3-4-11-12(14)13(16-17(11)2)9-5-7-10(15)8-6-9/h5-8H,3-4H2,1-2H3
InChIKey WIRPIWVWRZOBCG-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol2004947
Molecular Weight 313.626 g/mol
SMILES c1(n[n](c(c1Br)CCC)C)-c1ccc(cc1)Cl
SPLASH splash10-0bti-0093000000-a5238482c931b0b53296
Source of Spectrum A1-13-2082/SMSI6-2f
Wiley ID 1753145