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Ethyl 5-cyano-1-phenyl-4-{[(phenylimino)methylene]-amino}-1,4-dihydropyrazorol-3-carboxylate
SpectraBase Compound ID KWOJBquWMhm
InChI InChI=1S/C20H15N5O2/c1-2-27-20(26)19-18(23-14-22-15-9-5-3-6-10-15)17(13-21)25(24-19)16-11-7-4-8-12-16/h3-12H,2H2,1H3
InChIKey VEHZGKJMTUFOTL-UHFFFAOYSA-N
Mol Weight 357.37 g/mol
Molecular Formula C20H15N5O2
Exact Mass 357.122575 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CJzlnzwaht8
Name Ethyl 5-cyano-1-phenyl-4-{[(phenylimino)methylene]-amino}-1,4-dihydropyrazorol-3-carboxylate
Alternate Name(s) Ethyl 5-cyano-1-phenyl-4-(((phenylimino)methylene)amino)-1H-pyrazole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15N5O2
InChI InChI=1S/C20H15N5O2/c1-2-27-20(26)19-18(23-14-22-15-9-5-3-6-10-15)17(13-21)25(24-19)16-11-7-4-8-12-16/h3-12H,2H2,1H3
InChIKey VEHZGKJMTUFOTL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.201200142
Molecular Weight 357.373 g/mol
SMILES c1(C(OCC)=O)n[n](c(C#N)c1N=C=Nc1ccccc1)-c1ccccc1
SPLASH splash10-056r-1009000000-572b25a1a5a4f9d2b29c
Source of Spectrum APC-345-890-4
Wiley ID 1769278