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(2-HEXAHYDRO-1H-1,3-DIAZEPINYLIDENE)-(4-NITROPHENYL)-ACETONITRILE
SpectraBase Compound ID Jg9zxEKu5Ak
InChI InChI=1S/C13H14N4O2/c14-9-12(13-15-7-1-2-8-16-13)10-3-5-11(6-4-10)17(18)19/h3-6,15-16H,1-2,7-8H2
InChIKey JDMFDNZLDPMFDU-UHFFFAOYSA-N
Mol Weight 258.28 g/mol
Molecular Formula C13H14N4O2
Exact Mass 258.111676 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FyIuvaQvjGX
Name (2-HEXAHYDRO-1H-1,3-DIAZEPINYLIDENE)-(4-NITROPHENYL)-ACETONITRILE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14N4O2
InChI InChI=1S/C13H14N4O2/c14-9-12(13-15-7-1-2-8-16-13)10-3-5-11(6-4-10)17(18)19/h3-6,15-16H,1-2,7-8H2
InChIKey JDMFDNZLDPMFDU-UHFFFAOYSA-N
Literature Reference Author Z.T.HUANG,W.X.GAN,X.J.WANG
Literature Reference Citation J.PRAKT.CHEM.,330,724(1988)
Literature Reference DOI 10.1002/prac.19883300507
Molecular Weight 258.280 g/mol
Solvent DMSO-D6
Source File Reference UWED13698