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1H-Pyrazole-4-carboxylic acid, 5-amino-1-[(2-chlorophenyl)methyl]-, ethyl ester
SpectraBase Compound ID 38rVgKKPgoc
InChI InChI=1S/C13H14ClN3O2/c1-2-19-13(18)10-7-16-17(12(10)15)8-9-5-3-4-6-11(9)14/h3-7H,2,8,15H2,1H3
InChIKey CHLSZKUFTHCDDD-UHFFFAOYSA-N
Mol Weight 279.73 g/mol
Molecular Formula C13H14ClN3O2
Exact Mass 279.077454 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CbIgcL71mco
Name 1H-Pyrazole-4-carboxylic acid, 5-amino-1-[(2-chlorophenyl)methyl]-, ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14ClN3O2
InChI InChI=1S/C13H14ClN3O2/c1-2-19-13(18)10-7-16-17(12(10)15)8-9-5-3-4-6-11(9)14/h3-7H,2,8,15H2,1H3
InChIKey CHLSZKUFTHCDDD-UHFFFAOYSA-N
Molecular Weight 279.727 g/mol
SMILES Nc1c(cn[n]1Cc1c(Cl)cccc1)C(=O)OCC
SPLASH splash10-004m-3690000000-210d26c15740089b1dce
Source of Spectrum IY-2-4906-4
Synonyms 5-Amino-1-[(2-chlorophenyl)methyl]-4-pyrazolecarboxylic acid ethyl ester Ethyl 5-amino-1-[(2-chlorophenyl)methyl]pyrazole-4-carboxylate Ethyl 5-azanyl-1-[(2-chlorophenyl)methyl]pyrazole-4-carboxylate
Wiley ID 1657047