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ROTAMER-#1
SpectraBase Compound ID 9spwHWTWgl8
InChI InChI=1S/C4H5N5O2/c5-2-3(6-1-10)8-9-4(11)7-2/h1H,(H,6,8,10)(H3,5,7,9,11)
InChIKey QRQBTDPNFLSOGP-UHFFFAOYSA-N
Mol Weight 155.12 g/mol
Molecular Formula C4H5N5O2
Exact Mass 155.044324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IK68MzUGuzy
Name ROTAMER-#2
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C4H5N5O2
InChI InChI=1S/C4H5N5O2/c5-2-3(6-1-10)8-9-4(11)7-2/h1H,(H,6,8,10)(H3,5,7,9,11)
InChIKey QRQBTDPNFLSOGP-UHFFFAOYSA-N
Literature Reference Author C.C.TZENG,R.P.PANZICA,J.RIAND,M.T.CHENON
Literature Reference Citation J.CHEM.SOC.PERKIN-2,2563(1994)
Literature Reference DOI 10.1039/p29940002563
Molecular Weight 155.116 g/mol
Solvent DMSO-D6
Source File Reference WANG1252