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(2-HEXAHYDROPYRIMIDINYLIDENE)-(4-BROMOPHENYL)-ACETONITRILE

View entire compound with spectra: 1 NMR

(2-HEXAHYDROPYRIMIDINYLIDENE)-(4-BROMOPHENYL)-ACETONITRILE
SpectraBase Compound ID 5n1JJMF9kKk
InChI InChI=1S/C12H12BrN3/c13-10-4-2-9(3-5-10)11(8-14)12-15-6-1-7-16-12/h2-5,15-16H,1,6-7H2
InChIKey ZUHSYMRRFZKGCI-UHFFFAOYSA-N
Mol Weight 278.15 g/mol
Molecular Formula C12H12BrN3
Exact Mass 277.02146 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JaFCylHFiFX
Name (2-HEXAHYDROPYRIMIDINYLIDENE)-(4-BROMOPHENYL)-ACETONITRILE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12BrN3
InChI InChI=1S/C12H12BrN3/c13-10-4-2-9(3-5-10)11(8-14)12-15-6-1-7-16-12/h2-5,15-16H,1,6-7H2
InChIKey ZUHSYMRRFZKGCI-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 278.151 g/mol
Solvent DMSO-D6
Source File Reference UWED13690