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5-(2-THIENYL)-1,3-DIHYDRO-1-METHYL-2H-1,4-BENZODIAZEPIN-2-ONE
SpectraBase Compound ID 81GpocBusBT
InChI InChI=1S/C14H12N2OS/c1-16-11-6-3-2-5-10(11)14(15-9-13(16)17)12-7-4-8-18-12/h2-8H,9H2,1H3
InChIKey DXMHUSGJBFDYLS-UHFFFAOYSA-N
Mol Weight 256.32 g/mol
Molecular Formula C14H12N2OS
Exact Mass 256.067034 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AVWOmMvQ7y5
Name 5-(2-THIENYL)-1,3-DIHYDRO-1-METHYL-2H-1,4-BENZODIAZEPIN-2-ONE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H12N2OS
InChI InChI=1S/C14H12N2OS/c1-16-11-6-3-2-5-10(11)14(15-9-13(16)17)12-7-4-8-18-12/h2-8H,9H2,1H3
InChIKey DXMHUSGJBFDYLS-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 256.322 g/mol
Solvent CDCl3
Source File Reference UWSI22728