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1-BENZYL-5-TERT.-BUTOXYCARBONYL-7-CYANO-7-METHYLHEXAHYDRO-1H-PYRROLO-[1,2-A]-IMIDAZOLE;ENDO-ISOMER
SpectraBase Compound ID 9v85DmVFzIr
InChI InChI=1S/C20H27N3O2/c1-19(2,3)25-17(24)16-12-20(4,14-21)18-22(10-11-23(16)18)13-15-8-6-5-7-9-15/h5-9,16,18H,10-13H2,1-4H3/t16-,18-,20-/m0/s1
InChIKey WLSDXZYBICSBGE-QRFRQXIXSA-N
Mol Weight 341.46 g/mol
Molecular Formula C20H27N3O2
Exact Mass 341.210327 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4ApvWSXISsn
Name 1-BENZYL-5-TERT.-BUTOXYCARBONYL-7-CYANO-7-METHYLHEXAHYDRO-1H-PYRROLO-[1,2-A]-IMIDAZOLE;ENDO-ISOMER
Compound Number 7G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H27N3O2
InChI InChI=1S/C20H27N3O2/c1-19(2,3)25-17(24)16-12-20(4,14-21)18-22(10-11-23(16)18)13-15-8-6-5-7-9-15/h5-9,16,18H,10-13H2,1-4H3/t16-,18-,20-/m0/s1
InChIKey WLSDXZYBICSBGE-QRFRQXIXSA-N
Literature Reference Author R.C.F.JONES,K.J.HOWARD,J.R.NICHOLS,J.S.SNAITH
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2061(1998)
Literature Reference DOI 10.1039/a802048e
Molecular Weight 341.453 g/mol
Solvent CDCl3