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exo-2-(Pyridazin-4-yl)-7-azabicyclo[2.2.1]heptane-7-carboxylic acid Ethyl Ester
SpectraBase Compound ID 4Fo3dyuV1HR
InChI InChI=1S/C13H17N3O2/c1-2-18-13(17)16-10-3-4-12(16)11(7-10)9-5-6-14-15-8-9/h5-6,8,10-12H,2-4,7H2,1H3/t10-,11+,12+/m1/s1
InChIKey JCXREFJQTNJQJM-WOPDTQHZSA-N
Mol Weight 247.3 g/mol
Molecular Formula C13H17N3O2
Exact Mass 247.132077 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hf4tahZxr3b
Name EXO-2-(PYRIDAZIN-4-YL)-7-AZABICYCLO-[2.2.1]-HEPTANE-7-CARBOXYLIC-ACID-ETHYLESTER
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H17N3O2
InChI InChI=1S/C13H17N3O2/c1-2-18-13(17)16-10-3-4-12(16)11(7-10)9-5-6-14-15-8-9/h5-6,8,10-12H,2-4,7H2,1H3/t10-,11+,12+/m1/s1
InChIKey JCXREFJQTNJQJM-WOPDTQHZSA-N
Literature Reference Author D.CHE,T.WEGGE,M.T.STUBBS,G.SEITZ,H.MEIER,C.METHFESSEL
Literature Reference Citation J.MED.CHEM.,44,47(2001)
Literature Reference DOI 10.1021/jm000949w
Molecular Weight 247.297 g/mol
Sample ID 43793
Solvent CDCl3