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4-chloro-1,3-dimethyl-1H-pyrazole-5-carboxylic acid
SpectraBase Compound ID CKvskH13AWo
InChI InChI=1S/C6H7ClN2O2/c1-3-4(7)5(6(10)11)9(2)8-3/h1-2H3,(H,10,11)
InChIKey BSCNPVBDEITWDU-UHFFFAOYSA-N
Mol Weight 174.59 g/mol
Molecular Formula C6H7ClN2O2
Exact Mass 174.019605 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LsRE9MBXzqY
Name 4-Chloro-1,3-dimethyl-1H-pyrazole-5-carboxylic acid
CAS Registry Number 98198-65-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H7ClN2O2
InChI InChI=1S/C6H7ClN2O2/c1-3-4(7)5(6(10)11)9(2)8-3/h1-2H3,(H,10,11)
InChIKey BSCNPVBDEITWDU-UHFFFAOYSA-N
Molecular Weight 174.587 g/mol
SMILES OC(c1[n](nc(c1Cl)C)C)=O
SPLASH splash10-00di-8900000000-9a547c8e35654bf792e1
Source of Spectrum AD-0-2532-0
Synonyms 4-Chloranyl-2,5-dimethyl-pyrazole-3-carboxylic acid 4-Chloro-2,5-dimethyl-3-pyrazolecarboxylic acid 4-Chloro-2,5-dimethyl-pyrazole-3-carboxylic acid Pyrazole-5-carboxylic acid, 4-chloro-1,3-dimethyl-
Wiley ID 1433923