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1-(benzyl)-4-(cyanomethyl)-4,5-dihydroazepine-3-carbonitrile

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1-(benzyl)-4-(cyanomethyl)-4,5-dihydroazepine-3-carbonitrile
SpectraBase Compound ID 9bIuLPFTk8M
InChI InChI=1S/C16H15N3/c17-9-8-15-7-4-10-19(13-16(15)11-18)12-14-5-2-1-3-6-14/h1-6,10,13,15H,7-8,12H2
InChIKey YWMJYOHWMSDAEO-UHFFFAOYSA-N
Mol Weight 249.32 g/mol
Molecular Formula C16H15N3
Exact Mass 249.126597 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LdGolpUuKB4
Name 1-(benzyl)-4-(cyanomethyl)-4,5-dihydroazepine-3-carbonitrile
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H15N3
InChI InChI=1S/C16H15N3/c17-9-8-15-7-4-10-19(13-16(15)11-18)12-14-5-2-1-3-6-14/h1-6,10,13,15H,7-8,12H2
InChIKey YWMJYOHWMSDAEO-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 249.315 g/mol
Source File Reference MHKO6936