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2,3-DIAZA-7-(5'-METHYLIDENE-6'-OXOHEPTANYLIDENE)-BICYCLO-[2.2.1]-HEPT-2-ENE
SpectraBase Compound ID GmnKZoLE3k9
InChI InChI=1S/C13H18N2O/c1-9(10(2)16)5-3-4-6-11-12-7-8-13(11)15-14-12/h6,12-13H,1,3-5,7-8H2,2H3/b11-6-/t12-,13+/m1/s1
InChIKey XPBJRKRVYWTGCR-CUBYMHMKSA-N
Mol Weight 218.3 g/mol
Molecular Formula C13H18N2O
Exact Mass 218.141913 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2FgtRBOUar9
Name 2,3-DIAZA-7-(5'-METHYLIDENE-6'-OXOHEPTANYLIDENE)-BICYCLO-[2.2.1]-HEPT-2-ENE
CAS Registry Number 125877-64-7
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18N2O
InChI InChI=1S/C13H18N2O/c1-9(10(2)16)5-3-4-6-11-12-7-8-13(11)15-14-12/h6,12-13H,1,3-5,7-8H2,2H3/b11-6-/t12-,13+/m1/s1
InChIKey XPBJRKRVYWTGCR-CUBYMHMKSA-N
Literature Reference Author M.R.MASJEDIZADEH,I.DANNECKER-DOERIG,R.D.LITTLE
Literature Reference Citation J.ORG.CHEM.,55,2742(1990)
Literature Reference DOI 10.1021/jo00296a035
Molecular Weight 218.299 g/mol
Solvent CDCl3
Source File Reference UWCS12502