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DENXRFIVWCKMBR-UHFFFAOYSA-N
SpectraBase Compound ID CVz1g4KhTEi
InChI InChI=1S/C6H8N6O/c7-5-1-3-12(6(13)10-5)4-2-9-11-8/h1,3H,2,4H2,(H2,7,10,13)
InChIKey DENXRFIVWCKMBR-UHFFFAOYSA-N
Mol Weight 180.17 g/mol
Molecular Formula C6H8N6O
Exact Mass 180.075959 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HxmxRHJByKd
Name DENXRFIVWCKMBR-UHFFFAOYSA-N
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H8N6O
InChI InChI=1S/C6H8N6O/c7-5-1-3-12(6(13)10-5)4-2-9-11-8/h1,3H,2,4H2,(H2,7,10,13)
InChIKey DENXRFIVWCKMBR-UHFFFAOYSA-N
Literature Reference Author E.KOLEHMAINEN,K.LAPPALAINEN,D.SAMAN,A.HOLY,J.GUENTER
Literature Reference Citation MAGN.RES.CHEM.,36,442(1998)
Literature Reference DOI 10.1002/(sici)1097-458x(199806)36:6<442::aid-omr314>3.0.co;2-g
Molecular Weight 180.169 g/mol
Solvent DMSO-D6
Source File Reference UWBS131