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2,5-Benzodiazocine-3,4-dicarbonitrile
SpectraBase Compound ID Garhxe3faYz
InChI InChI=1S/C12H6N4/c13-5-11-12(6-14)16-8-10-4-2-1-3-9(10)7-15-11/h1-4,7-8H/b9-7-,10-8-,12-11-,15-7-,15-11-,16-8-,16-12-
InChIKey RYXJCLYQMIJMLS-QLLXQNDJSA-N
Mol Weight 206.21 g/mol
Molecular Formula C12H6N4
Exact Mass 206.059246 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BLjI319iGd
Name 2,5-Benzodiazocine-3,4-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H6N4
InChI InChI=1S/C12H6N4/c13-5-11-12(6-14)16-8-10-4-2-1-3-9(10)7-15-11/h1-4,7-8H/b9-7-,10-8-,12-11-,15-7-,15-11-,16-8-,16-12-
InChIKey RYXJCLYQMIJMLS-QLLXQNDJSA-N
Literature Reference DOI 10.1002/hc.20212
Molecular Weight 206.208 g/mol
SMILES c12\C=N/C(=C/(\N=C/c2cccc1)C#N)C#N
SPLASH splash10-0gir-9700000000-d4f4a606d3b062f4968f
Source of Spectrum HAC-17-368-12
Synonyms (1Z,3Z,5Z)-benzo[f][1,4]diazocine-3,4-dicarbonitrile
Wiley ID 1783669