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Ethyl 1-Phenyl-3-(3-thienylethynyl)-1H-pyrazole-4-carboxylate

View entire compound with spectra: 1 MS (GC)

Ethyl 1-Phenyl-3-(3-thienylethynyl)-1H-pyrazole-4-carboxylate
SpectraBase Compound ID 6URFtL1hxGT
InChI InChI=1S/C18H14N2O2S/c1-2-22-18(21)16-12-20(15-6-4-3-5-7-15)19-17(16)9-8-14-10-11-23-13-14/h3-7,10-13H,2H2,1H3
InChIKey IXTSWEQDUANCCG-UHFFFAOYSA-N
Mol Weight 322.38 g/mol
Molecular Formula C18H14N2O2S
Exact Mass 322.077599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7iX82Czdx11
Name Ethyl 1-Phenyl-3-(3-thienylethynyl)-1H-pyrazole-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14N2O2S
InChI InChI=1S/C18H14N2O2S/c1-2-22-18(21)16-12-20(15-6-4-3-5-7-15)19-17(16)9-8-14-10-11-23-13-14/h3-7,10-13H,2H2,1H3
InChIKey IXTSWEQDUANCCG-UHFFFAOYSA-N
Molecular Weight 322.382 g/mol
SMILES c1(c(n[n](c1)-c1ccccc1)C#Cc1cscc1)C(=O)OCC
SPLASH splash10-00di-4259000000-3d4cba677eb325995248
Source of Spectrum U1-2011-1885-6b
Synonyms 1-Phenyl-3-[2-(3-thiophenyl)ethynyl]-4-pyrazolecarboxylic acid ethyl ester Ethyl 1-phenyl-3-[2-(3-thienyl)ethynyl]pyrazole-4-carboxylate Ethyl 1-phenyl-3-(2-thiophen-3-ylethynyl)pyrazole-4-carboxylate
Wiley ID 1665073