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5-(PHENYLALKYNYL)-1,3-DIHYDRO-1-METHYL-2H-1,4-BENZODIAZEPIN-2-ONE
SpectraBase Compound ID AeUeQTaCk5U
InChI InChI=1S/C18H14N2O/c1-20-17-10-6-5-9-15(17)16(19-13-18(20)21)12-11-14-7-3-2-4-8-14/h2-10H,13H2,1H3
InChIKey LIQAPWCEMPBMQF-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 37BRyqY7PXt
Name 5-(PHENYLALKYNYL)-1,3-DIHYDRO-1-METHYL-2H-1,4-BENZODIAZEPIN-2-ONE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H14N2O
InChI InChI=1S/C18H14N2O/c1-20-17-10-6-5-9-15(17)16(19-13-18(20)21)12-11-14-7-3-2-4-8-14/h2-10H,13H2,1H3
InChIKey LIQAPWCEMPBMQF-UHFFFAOYSA-N
Literature Reference Author A.NADIN,J.M.S.LOPEZ,A.P.OWENS,D.M.HOWELLS,A.C.TALBOT,T.HARRI SON
Literature Reference Citation J.ORG.CHEM.,68,2844(2003)
Literature Reference DOI 10.1021/jo026860a
Molecular Weight 274.322 g/mol
Solvent CDCl3
Source File Reference UWSI22730