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(2-HEXAHYDROPYRIMIDINYLIDENE)-PHENYLACETONITRILE

View entire compound with spectra: 2 NMR

(2-HEXAHYDROPYRIMIDINYLIDENE)-PHENYLACETONITRILE
SpectraBase Compound ID LF3aUSPnWDq
InChI InChI=1S/C12H13N3/c13-9-11(10-5-2-1-3-6-10)12-14-7-4-8-15-12/h1-3,5-6,14-15H,4,7-8H2
InChIKey XDECUCYBIRHHPC-UHFFFAOYSA-N
Mol Weight 199.26 g/mol
Molecular Formula C12H13N3
Exact Mass 199.110947 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5n78jOfWl85
Name (2-HEXAHYDROPYRIMIDINYLIDENE)-PHENYLACETONITRILE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13N3
InChI InChI=1S/C12H13N3/c13-9-11(10-5-2-1-3-6-10)12-14-7-4-8-15-12/h1-3,5-6,14-15H,4,7-8H2
InChIKey XDECUCYBIRHHPC-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 199.255 g/mol
Solvent DMSO-D6
Source File Reference UWED13685