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5-AMINO-4-CYANO-1-METHOXYCARBONYLPYRAZOLE
SpectraBase Compound ID ByJ8TeONDRr
InChI InChI=1S/C6H6N4O2/c1-12-6(11)10-5(8)4(2-7)3-9-10/h3H,8H2,1H3
InChIKey BCAGGGNPYWRFJL-UHFFFAOYSA-N
Mol Weight 166.14 g/mol
Molecular Formula C6H6N4O2
Exact Mass 166.049075 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cjx2YhpjqQK
Name 5-AMINO-4-CYANO-1-METHOXYCARBONYLPYRAZOLE
Compound Number 3 A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H6N4O2
InChI InChI=1S/C6H6N4O2/c1-12-6(11)10-5(8)4(2-7)3-9-10/h3H,8H2,1H3
InChIKey BCAGGGNPYWRFJL-UHFFFAOYSA-N
Literature Reference Author C.REIDLINGER,R.DWORCZAK,H.JUNEK,H.GRAUBAUM
Literature Reference Citation MH.CHEM.,129,1313(1998)
Literature Reference DOI 10.1007/s007060050154
Molecular Weight 166.139 g/mol
Solvent DMSO-D6
Source File Reference UWRU2831