For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5-(4-Chlorostyryl)-2,3-dicyano-7-methyl-6H-1,4-diazepine
SpectraBase Compound ID JcU5oZTPGii
InChI InChI=1S/C16H11ClN4/c1-11-8-14(21-16(10-19)15(9-18)20-11)7-4-12-2-5-13(17)6-3-12/h2-7H,8H2,1H3/b7-4+
InChIKey YVKVPOOCRUNZOE-QPJJXVBHSA-N
Mol Weight 294.75 g/mol
Molecular Formula C16H11ClN4
Exact Mass 294.067224 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID LYgTLUrPDOa
Name 5-(4-Chlorostyryl)-2,3-dicyano-7-methyl-6H-1,4-diazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11ClN4
InChI InChI=1S/C16H11ClN4/c1-11-8-14(21-16(10-19)15(9-18)20-11)7-4-12-2-5-13(17)6-3-12/h2-7H,8H2,1H3/b7-4+
InChIKey YVKVPOOCRUNZOE-QPJJXVBHSA-N
Molecular Weight 294.745 g/mol
SMILES C=1(N=C(CC(=NC1C#N)\C=C\c1ccc(cc1)Cl)C)C#N
SPLASH splash10-002f-0390000000-6f54aa25c59872b533bb
Source of Spectrum HC-78-320-16
Synonyms 5-[(E)-2-(4-chlorophenyl)ethenyl]-7-methyl-6H-1,4-diazepine-2,3-dicarbonitrile
Wiley ID 1612699