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3-(PARA-METHYLPHENYL)-2,4-DIAZABICYCLO-[4.2.0]-OCTA-1-(6),2-DIEN-5-ONE
SpectraBase Compound ID 8w4xFbKBxEx
InChI InChI=1S/C13H12N2O/c1-8-2-4-9(5-3-8)12-14-11-7-6-10(11)13(16)15-12/h2-5H,6-7H2,1H3,(H,14,15,16)
InChIKey UWSDMSWCCSWYKN-UHFFFAOYSA-N
Mol Weight 212.25 g/mol
Molecular Formula C13H12N2O
Exact Mass 212.094963 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HG1sTyUcPpw
Name 3-(PARA-METHYLPHENYL)-2,4-DIAZABICYCLO-[4.2.0]-OCTA-1-(6),2-DIEN-5-ONE
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H12N2O
InChI InChI=1S/C13H12N2O/c1-8-2-4-9(5-3-8)12-14-11-7-6-10(11)13(16)15-12/h2-5H,6-7H2,1H3,(H,14,15,16)
InChIKey UWSDMSWCCSWYKN-UHFFFAOYSA-N
Literature Reference Author M.W.NOETZEL,K.RAUCH,T.LABAHN,A.DEMEIJERE
Literature Reference Citation ORG.LETTERS,4,839(2002)
Literature Reference DOI 10.1021/ol025530+
Molecular Weight 212.251 g/mol
Solvent CDCl3
Source File Reference UWMZ25381