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Purine

View entire compound with spectra: 23 NMR, 4 FTIR, and 3 MS (GC)

Purine
SpectraBase Compound ID H97uewxwp4t
InChI InChI=1S/C5H4N4/c1-4-5(8-2-6-1)9-3-7-4/h1-3H,(H,6,7,8,9)
InChIKey KDCGOANMDULRCW-UHFFFAOYSA-N
Mol Weight 120.11 g/mol
Molecular Formula C5H4N4
Exact Mass 120.043596 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ano3ZFd9h5K
Name PURINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H4N4
InChI InChI=1S/C5H4N4/c1-4-5(8-2-6-1)9-3-7-4/h1-3H,(H,6,7,8,9)
InChIKey KDCGOANMDULRCW-UHFFFAOYSA-N
Literature Reference Author E.BREITMAIER,W.VOELTER
Literature Reference Citation TETRAHEDRON,30,3941(1974)
Literature Reference DOI 10.1016/S0040-4020(01)97088-7
Molecular Weight 120.114 g/mol
Solvent DMSO-D6
Source File Reference UNIW11383