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3,6-BIS-(3-METHYLBUTYL)-PHTHALONITRILE
SpectraBase Compound ID 74RmvijUZbu
InChI InChI=1S/C18H24N2/c1-13(2)5-7-15-9-10-16(8-6-14(3)4)18(12-20)17(15)11-19/h9-10,13-14H,5-8H2,1-4H3
InChIKey NVZGCNLLZAXOMS-UHFFFAOYSA-N
Mol Weight 268.4 g/mol
Molecular Formula C18H24N2
Exact Mass 268.193949 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4UlVOOipqmO
Name 3,6-BIS-(3-METHYLBUTYL)-PHTHALONITRILE
Compound Number 6E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H24N2
InChI InChI=1S/C18H24N2/c1-13(2)5-7-15-9-10-16(8-6-14(3)4)18(12-20)17(15)11-19/h9-10,13-14H,5-8H2,1-4H3
InChIKey NVZGCNLLZAXOMS-UHFFFAOYSA-N
Literature Reference Author D.J.TATE,R.ANEMIAN,R.J.BUSHBY,S.NANAN,S.L.WARRINER,B.J.WHITA KER
Literature Reference Citation BEIL.J.ORG.CHEM.,8,120(2012)
Literature Reference DOI 10.3762/bjoc.8.14
Molecular Weight 268.402 g/mol
Solvent CDCl3
Source File Reference UWIR10107