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ALPHA-(AMINOMETHYLENE)-6-PURINEACETONITRILE;Z-ISOMER

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ALPHA-(AMINOMETHYLENE)-6-PURINEACETONITRILE;Z-ISOMER
SpectraBase Compound ID DFvA1LPl9LJ
InChI InChI=1S/C8H6N6/c9-1-5(2-10)6-7-8(13-3-11-6)14-4-12-7/h1,3-4H,9H2,(H,11,12,13,14)/b5-1+
InChIKey FKOFSPULDHWLDA-ORCRQEGFSA-N
Mol Weight 186.18 g/mol
Molecular Formula C8H6N6
Exact Mass 186.065394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Jxq7Wyg8Qu
Name ALPHA-(AMINOMETHYLENE)-6-PURINEACETONITRILE;Z-ISOMER
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H6N6
InChI InChI=1S/C8H6N6/c9-1-5(2-10)6-7-8(13-3-11-6)14-4-12-7/h1,3-4H,9H2,(H,11,12,13,14)/b5-1+
InChIKey FKOFSPULDHWLDA-ORCRQEGFSA-N
Literature Reference Author N.HAMAMICHI,T.MIYASAKA
Literature Reference Citation HETEROCYCLES,31,321(1990)
Literature Reference DOI 10.3987/COM-89-5242
Molecular Weight 186.176 g/mol
Solvent DMSO-D6
Source File Reference UWMZ1155