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(E)-3-(5-amino-3-methylpyrazol-1-yl)but-2-enenitrile
SpectraBase Compound ID AP5DEaGSvP2
InChI InChI=1S/C8H10N4/c1-6-5-8(10)12(11-6)7(2)3-4-9/h3,5H,10H2,1-2H3/b7-3+
InChIKey PKQNVNIJPKXWAL-XVNBXDOJSA-N
Mol Weight 162.2 g/mol
Molecular Formula C8H10N4
Exact Mass 162.090546 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E3Dyg1ft4SR
Name (E)-3-(5-amino-3-methylpyrazol-1-yl)but-2-enenitrile
Compound Number 967
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H10N4
InChI InChI=1S/C8H10N4/c1-6-5-8(10)12(11-6)7(2)3-4-9/h3,5H,10H2,1-2H3/b7-3+
InChIKey PKQNVNIJPKXWAL-XVNBXDOJSA-N
Literature Reference Author M.BEGTRUP,G.BOYER,P.CABILDO,C.CATIVIELA,R.M.CLARAMUNT,J.ELGU ERO,J.I.GARCIA,C.TOI
Literature Reference Citation MAGN.RES.CHEM.,31,107(1993)
Literature Reference DOI 10.1002/mrc.1260310202
Molecular Weight 162.194 g/mol
Solvent DMSO-D6
Source File Reference UWVP2274