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4-Bromo-1-methyl-1H-pyrazole-3-carboxylic acid
SpectraBase Compound ID AYOdZILqdps
InChI InChI=1S/C5H5BrN2O2/c1-8-2-3(6)4(7-8)5(9)10/h2H,1H3,(H,9,10)
InChIKey LEEPGDCCHVRYHK-UHFFFAOYSA-N
Mol Weight 205.01 g/mol
Molecular Formula C5H5BrN2O2
Exact Mass 203.95344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ASeuZABQjZQ
Name 4-Bromo-1-methyl-1H-pyrazole-3-carboxylic acid
CAS Registry Number 84547-86-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H5BrN2O2
InChI InChI=1S/C5H5BrN2O2/c1-8-2-3(6)4(7-8)5(9)10/h2H,1H3,(H,9,10)
InChIKey LEEPGDCCHVRYHK-UHFFFAOYSA-N
Molecular Weight 205.011 g/mol
SMILES OC(c1c(c[n](n1)C)Br)=O
SPLASH splash10-0k9f-9330000000-cef116013f64a183bc77
Source of Spectrum AD-0-2532-0
Synonyms 1H-Pyrazole-3-carboxylic acid, 4-bromo-1-methyl- 4-Bromanyl-1-methyl-pyrazole-3-carboxylic acid 4-Bromo-1-methyl-3-pyrazolecarboxylic acid 4-Bromo-1-methyl-pyrazole-3-carboxylic acid
Wiley ID 1433921