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3-(1-METHYL-1H-IMIDAZOL-4-YL)-3-OXO-PROPIONITRILE
SpectraBase Compound ID HhSsSdHljPV
InChI InChI=1S/C7H7N3O/c1-10-4-6(9-5-10)7(11)2-3-8/h4-5H,2H2,1H3
InChIKey UVIDEKGKJUIKFX-UHFFFAOYSA-N
Mol Weight 149.15 g/mol
Molecular Formula C7H7N3O
Exact Mass 149.058912 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID U0qQOtFfYc
Name 3-(1-METHYL-1H-IMIDAZOL-4-YL)-3-OXO-PROPIONITRILE
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H7N3O
InChI InChI=1S/C7H7N3O/c1-10-4-6(9-5-10)7(11)2-3-8/h4-5H,2H2,1H3
InChIKey UVIDEKGKJUIKFX-UHFFFAOYSA-N
Literature Reference Author H.M.AL-MATAR,K.D.KHALIL,M.F.AL-KANDERI,M.H.ELNAGDI
Literature Reference Citation MOLECULES,17,897(2012)
Literature Reference DOI 10.3390/molecules17010897
Molecular Weight 149.152 g/mol
Sample ID 73053
Solvent DMSO-D6