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1-Benzyl-4-bromo-5-methylpyrazole

View entire compound with spectra: 2 NMR, and 1 MS (GC)

1-Benzyl-4-bromo-5-methylpyrazole
SpectraBase Compound ID Fcj9qct0Zlk
InChI InChI=1S/C11H11BrN2/c1-9-11(12)7-13-14(9)8-10-5-3-2-4-6-10/h2-7H,8H2,1H3
InChIKey NNRAYIHDNCLVCL-UHFFFAOYSA-N
Mol Weight 251.13 g/mol
Molecular Formula C11H11BrN2
Exact Mass 250.010561 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EYZjdmwdcHp
Name 1-Benzyl-4-bromo-5-methylpyrazole
Alternate Name(s) 4-Bromanyl-5-methyl-1-(phenylmethyl)pyrazole 4-Bromo-5-methyl-1-(phenylmethyl)pyrazole
CAS Registry Number 137968-32-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11BrN2
InChI InChI=1S/C11H11BrN2/c1-9-11(12)7-13-14(9)8-10-5-3-2-4-6-10/h2-7H,8H2,1H3
InChIKey NNRAYIHDNCLVCL-UHFFFAOYSA-N
Molecular Weight 251.127 g/mol
SMILES c1n[n](c(c1Br)C)Cc1ccccc1
SPLASH splash10-0awc-9100000000-282852406d93394cc95b
Source of Spectrum J-57-1567-7
Wiley ID 1252780