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Ethyl 5-amino-1-phenyl-1H-pyrazole-4-carboxylate

View entire compound with spectra: 6 NMR, 4 FTIR, 1 Raman, 1 UV-Vis, and 1 MS (GC)

Ethyl 5-amino-1-phenyl-1H-pyrazole-4-carboxylate
SpectraBase Compound ID CMsilautZUJ
InChI InChI=1S/C12H13N3O2/c1-2-17-12(16)10-8-14-15(11(10)13)9-6-4-3-5-7-9/h3-8H,2,13H2,1H3
InChIKey AYJIUOZKKTUKKD-UHFFFAOYSA-N
Mol Weight 231.25 g/mol
Molecular Formula C12H13N3O2
Exact Mass 231.100777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jo8BS7zSVf5
Name Ethyl 5-amino-1-phenyl-1H-pyrazole-4-carboxylate
CAS Registry Number 16078-71-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N3O2
InChI InChI=1S/C12H13N3O2/c1-2-17-12(16)10-8-14-15(11(10)13)9-6-4-3-5-7-9/h3-8H,2,13H2,1H3
InChIKey AYJIUOZKKTUKKD-UHFFFAOYSA-N
Molecular Weight 231.255 g/mol
SMILES Nc1c(cn[n]1-c1ccccc1)C(=O)OCC
SPLASH splash10-0far-9720000000-8c855825a96838d51f48
Synonyms 1H-Pyrazole-4-carboxylic acid, 5-amino-1-phenyl-, ethyl ester 3-Amino-4-carbethoxy-2-phenylpyrazole 5-Amino-1-phenyl-4-pyrazolecarboxylic acid ethyl ester 5-Amino-1-phenyl-pyrazole-4-carboxylic acid ethyl ester 5-Amino-4-carboethoxy-1-phenylpyrazole Ethyl 3-amino-2-phenylpyrazole-4-carboxylate Ethyl 5-amino-1-phenyl-pyrazole-4-carboxylate Ethyl 5-azanyl-1-phenyl-pyrazole-4-carboxylate EINECS 240-224-8
Wiley ID 1455330