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1,5-DIACETYL-2,3,4,5-TETRAHYDRO-1H-1,5-BENZODIAZEPIN-2-ONE
SpectraBase Compound ID 80GqWVQJLFI
InChI InChI=1S/C13H14N2O3/c1-9(16)14-8-7-13(18)15(10(2)17)12-6-4-3-5-11(12)14/h3-6H,7-8H2,1-2H3
InChIKey XQPWBNMUQZEOOK-UHFFFAOYSA-N
Mol Weight 246.27 g/mol
Molecular Formula C13H14N2O3
Exact Mass 246.100442 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J5Cag1TOWYP
Name 1,5-DIACETYL-2,3,4,5-TETRAHYDRO-1H-1,5-BENZODIAZEPIN-2-ONE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14N2O3
InChI InChI=1S/C13H14N2O3/c1-9(16)14-8-7-13(18)15(10(2)17)12-6-4-3-5-11(12)14/h3-6H,7-8H2,1-2H3
InChIKey XQPWBNMUQZEOOK-UHFFFAOYSA-N
Literature Reference Author B.D.PUODZIUNAITE,G.MIKULSKIENE,R.JANCIENE,Z.STUMBREVICIUTE
Literature Reference Citation MAGN.RES.CHEM.,34,324(1996)
Literature Reference DOI 10.1002/(sici)1097-458x(199604)34:4<324::aid-omr835>3.0.co;2-b
Molecular Weight 246.266 g/mol
Solvent DMSO-D6
Source File Reference UWRK3740