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N-[(E)-2-cyano-3-(2,4-dichlorophenyl)-1-oxoprop-2-enyl]-3-nitro-1-pyrazolecarboxamide
SpectraBase Compound ID G3F2MfXpjGZ
InChI InChI=1S/C14H7Cl2N5O4/c15-10-2-1-8(11(16)6-10)5-9(7-17)13(22)18-14(23)20-4-3-12(19-20)21(24)25/h1-6H,(H,18,22,23)/b9-5+
InChIKey JLNQMZHJMYKNCU-WEVVVXLNSA-N
Mol Weight 380.15 g/mol
Molecular Formula C14H7Cl2N5O4
Exact Mass 378.987509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IELqClUC1lw
Name N-[(E)-2-cyano-3-(2,4-dichlorophenyl)-1-oxoprop-2-enyl]-3-nitro-1-pyrazolecarboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H7Cl2N5O4
InChI InChI=1S/C14H7Cl2N5O4/c15-10-2-1-8(11(16)6-10)5-9(7-17)13(22)18-14(23)20-4-3-12(19-20)21(24)25/h1-6H,(H,18,22,23)/b9-5+
InChIKey JLNQMZHJMYKNCU-WEVVVXLNSA-N
Molecular Weight 380.147 g/mol
SMILES N(C(\C(=C\c1c(cc(cc1)Cl)Cl)C#N)=O)C([n]1nc(cc1)N(=O)=O)=O
SPLASH splash10-001i-6690000000-fbfed598e8c18b5c90a9
Synonyms N-[(E)-2-cyano-3-(2,4-dichlorophenyl)acryloyl]-3-nitro-pyrazole-1-carboxamide N-[(E)-2-cyano-3-(2,4-dichlorophenyl)prop-2-enoyl]-3-nitro-pyrazole-1-carboxamide
Wiley ID 1452649