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5-TERT.-BUTYL-1,2,4-BENZENETRICARBONITRILE
SpectraBase Compound ID 6XNHu9PRCEw
InChI InChI=1S/C13H11N3/c1-13(2,3)12-5-10(7-15)9(6-14)4-11(12)8-16/h4-5H,1-3H3
InChIKey IJCHULPUWLBCND-UHFFFAOYSA-N
Mol Weight 209.25 g/mol
Molecular Formula C13H11N3
Exact Mass 209.095297 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5H60VMFhWlu
Name 5-TERT.-BUTYL-1,2,4-BENZENETRICARBONITRILE
CAS Registry Number 132381-82-9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H11N3
InChI InChI=1S/C13H11N3/c1-13(2,3)12-5-10(7-15)9(6-14)4-11(12)8-16/h4-5H,1-3H3
InChIKey IJCHULPUWLBCND-UHFFFAOYSA-N
Literature Reference Author M.MELLA,E.FASANI,A.ALBINI
Literature Reference Citation J.ORG.CHEM.,57,3051(1992)
Literature Reference DOI 10.1021/jo00037a020
Molecular Weight 209.250 g/mol
Solvent CDCl3
Source File Reference UWCS7542