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(2-HEXAHYDRO-1H-1,3-DIAZEPINYLIDENE)-(4-FLUOROPHENYL)-ACETONITRILE
SpectraBase Compound ID 6woR3mtEOIQ
InChI InChI=1S/C13H14FN3/c14-11-5-3-10(4-6-11)12(9-15)13-16-7-1-2-8-17-13/h3-6,16-17H,1-2,7-8H2
InChIKey ORSMCOBLQUCUJI-UHFFFAOYSA-N
Mol Weight 231.27 g/mol
Molecular Formula C13H14FN3
Exact Mass 231.117176 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6GixNf3Ijw1
Name (2-HEXAHYDRO-1H-1,3-DIAZEPINYLIDENE)-(4-FLUOROPHENYL)-ACETONITRILE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14FN3
InChI InChI=1S/C13H14FN3/c14-11-5-3-10(4-6-11)12(9-15)13-16-7-1-2-8-17-13/h3-6,16-17H,1-2,7-8H2
InChIKey ORSMCOBLQUCUJI-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 231.273 g/mol
Solvent DMSO-D6
Source File Reference UWED13695