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Pyrazole-3-carboxylic acid, 1-(3-chloro-2-cyanophenyl)-5-methyl-, ethyl ester
SpectraBase Compound ID 2hAGkHz68rZ
InChI InChI=1S/C14H12ClN3O2/c1-3-20-14(19)12-7-9(2)18(17-12)13-6-4-5-11(15)10(13)8-16/h4-7H,3H2,1-2H3
InChIKey PNLNUGALWOGMKV-UHFFFAOYSA-N
Mol Weight 289.72 g/mol
Molecular Formula C14H12ClN3O2
Exact Mass 289.061804 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IRJsA2w8RkC
Name Pyrazole-3-carboxylic acid, 1-(3-chloro-2-cyanophenyl)-5-methyl-, ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12ClN3O2
InChI InChI=1S/C14H12ClN3O2/c1-3-20-14(19)12-7-9(2)18(17-12)13-6-4-5-11(15)10(13)8-16/h4-7H,3H2,1-2H3
InChIKey PNLNUGALWOGMKV-UHFFFAOYSA-N
Molecular Weight 289.722 g/mol
SMILES CCOC(c1n[n](c(c1)C)-c1c(C#N)c(Cl)ccc1)=O
SPLASH splash10-016u-4980000000-c1cd44c1246ef5b4bb3e
Source of Spectrum AD-0-2532-0
Synonyms 1-(3-Chloro-2-cyano-phenyl)-5-methyl-pyrazole-3-carboxylic acid ethyl ester 1-(3-Chloro-2-cyanophenyl)-5-methyl-3-pyrazolecarboxylic acid ethyl ester Ethyl 1-(3-chloranyl-2-cyano-phenyl)-5-methyl-pyrazole-3-carboxylate Ethyl 1-(3-chloro-2-cyano-phenyl)-5-methyl-pyrazole-3-carboxylate Ethyl 1-(3-chloro-2-cyanophenyl)-5-methyl-1H-pyrazole-3-carboxylate
Wiley ID 1431626