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3-METHYL-2-(4-TOLUOYL)-1,2-DIHYDROISOQUINOLINE-1-CARBONITRILE
SpectraBase Compound ID 3lbe6c0ZdAq
InChI InChI=1S/C19H16N2O/c1-13-7-9-15(10-8-13)19(22)21-14(2)11-16-5-3-4-6-17(16)18(21)12-20/h3-11,18H,1-2H3
InChIKey ZKDSVMUHWGNGQE-UHFFFAOYSA-N
Mol Weight 288.35 g/mol
Molecular Formula C19H16N2O
Exact Mass 288.126263 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2pRbgYvqAkj
Name 3-METHYL-2-(4-TOLUOYL)-1,2-DIHYDROISOQUINOLINE-1-CARBONITRILE
Compound Number 5C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H16N2O
InChI InChI=1S/C19H16N2O/c1-13-7-9-15(10-8-13)19(22)21-14(2)11-16-5-3-4-6-17(16)18(21)12-20/h3-11,18H,1-2H3
InChIKey ZKDSVMUHWGNGQE-UHFFFAOYSA-N
Literature Reference Author E.REIMANN,R.HERTEL,J.KRAUSS
Literature Reference Citation MH.CHEM.,139,673(2008)
Literature Reference DOI 10.1007/s00706-007-0826-8
Molecular Weight 288.349 g/mol
Sample ID 39768
Solvent CDCl3