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[6-(6-CHLOROPYRIDIN-3-YLMETHYL)-4,6-DIAZASPIRO-[2.4]-HEPT-5-YLIDENE]-CYANAMIDE
SpectraBase Compound ID HxJEXYRrgEW
InChI InChI=1S/C12H12ClN5/c13-10-2-1-9(5-15-10)6-18-7-12(3-4-12)17-11(18)16-8-14/h1-2,5H,3-4,6-7H2,(H,16,17)
InChIKey YNLIEOPFVLJJQK-UHFFFAOYSA-N
Mol Weight 261.72 g/mol
Molecular Formula C12H12ClN5
Exact Mass 261.078123 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AcCVM7ROi5r
Name [6-(6-CHLOROPYRIDIN-3-YLMETHYL)-4,6-DIAZASPIRO-[2.4]-HEPT-5-YLIDENE]-CYANAMIDE
Compound Number 19-CP
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12ClN5
InChI InChI=1S/C12H12ClN5/c13-10-2-1-9(5-15-10)6-18-7-12(3-4-12)17-11(18)16-8-14/h1-2,5H,3-4,6-7H2,(H,16,17)
InChIKey YNLIEOPFVLJJQK-UHFFFAOYSA-N
Literature Reference Author F.BRACKMANN,D.S.YUFIT,J.A.K.HOWARD,M.ES-SAYED,A.D.MEIJERE
Literature Reference Citation EUR.J.ORG.CHEM.,600(2005)
Molecular Weight 261.714 g/mol
Sample ID 39012
Solvent CDCl3