John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=BAeQKUFldym SpectraBase Spectrum ID=29lo2aHrbor

(accessed ).
[6-(6-CHLOROPYRIDIN-3-YLMETHYL)-4,6-DIAZASPIRO-[2.4]-HEPT-5-YLIDENE]-NITROAMIDE
SpectraBase Compound ID BAeQKUFldym
InChI InChI=1S/C11H12ClN5O2/c12-9-2-1-8(5-13-9)6-16-7-11(3-4-11)14-10(16)15-17(18)19/h1-2,5H,3-4,6-7H2,(H,14,15)
InChIKey CGTSPSQWAAMHJF-UHFFFAOYSA-N
Mol Weight 281.7 g/mol
Molecular Formula C11H12ClN5O2
Exact Mass 281.067952 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 29lo2aHrbor
Name [6-(6-CHLOROPYRIDIN-3-YLMETHYL)-4,6-DIAZASPIRO-[2.4]-HEPT-5-YLIDENE]-NITROAMIDE
Compound Number 20-CP
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H12ClN5O2
InChI InChI=1S/C11H12ClN5O2/c12-9-2-1-8(5-13-9)6-16-7-11(3-4-11)14-10(16)15-17(18)19/h1-2,5H,3-4,6-7H2,(H,14,15)
InChIKey CGTSPSQWAAMHJF-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 281.702 g/mol
Sample ID 39008
Solvent CDCl3
SpectraBase Batch ID AjM9kpdtut0