For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
EXO-2-(3,6-BIS-TRIFLUOROMETHYL-PYRIDAZIN-4-YL)-7-AZABICYCLO-[2.2.1]-HEPTANE
SpectraBase Compound ID HlmprJPsEF1
InChI InChI=1S/C12H11F6N3/c13-11(14,15)9-4-7(10(21-20-9)12(16,17)18)6-3-5-1-2-8(6)19-5/h4-6,8,19H,1-3H2/t5-,6+,8+/m1/s1
InChIKey ZCMOJPVILACFSQ-CHKWXVPMSA-N
Mol Weight 311.23 g/mol
Molecular Formula C12H11F6N3
Exact Mass 311.085716 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IC1zoFnJsa3
Name EXO-2-(3,6-BIS-TRIFLUOROMETHYL-PYRIDAZIN-4-YL)-7-AZABICYCLO-[2.2.1]-HEPTANE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H11F6N3
InChI InChI=1S/C12H11F6N3/c13-11(14,15)9-4-7(10(21-20-9)12(16,17)18)6-3-5-1-2-8(6)19-5/h4-6,8,19H,1-3H2/t5-,6+,8+/m1/s1
InChIKey ZCMOJPVILACFSQ-CHKWXVPMSA-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 311.230 g/mol
Sample ID 43791
Solvent CDCl3