John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=DpTTmvW0Skb SpectraBase Spectrum ID=46gMrtSQ68J

(accessed ).
2-BENZOYL-3-METHYL-1,2-DIHYDROISOQUINOLINE-1-CARBONITRILE
SpectraBase Compound ID DpTTmvW0Skb
InChI InChI=1S/C18H14N2O/c1-13-11-15-9-5-6-10-16(15)17(12-19)20(13)18(21)14-7-3-2-4-8-14/h2-11,17H,1H3
InChIKey XZDFOLUDAFZNQX-UHFFFAOYSA-N
Mol Weight 274.32 g/mol
Molecular Formula C18H14N2O
Exact Mass 274.110613 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 46gMrtSQ68J
Name 2-BENZOYL-3-METHYL-1,2-DIHYDROISOQUINOLINE-1-CARBONITRILE
Compound Number 5A
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H14N2O
InChI InChI=1S/C18H14N2O/c1-13-11-15-9-5-6-10-16(15)17(12-19)20(13)18(21)14-7-3-2-4-8-14/h2-11,17H,1H3
InChIKey XZDFOLUDAFZNQX-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 274.322 g/mol
Sample ID 39766
Solvent CDCl3
SpectraBase Batch ID 3wndg0H1YfC