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(1-R*,3A-R*,3B-S*)-1,2,3B,4-TETRAHYDRO-1-ETHYL-3A-METHYL-7-PHENYL-4,10-ETHENO-6-H,10-H-CYCLOPENTA-[1.3]-CYCLOPROPA-[1.2-D]-[1.2.4]-TRIA
SpectraBase Compound ID LlTIRbbB3J9
InChI InChI=1S/C21H21N3O3/c1-3-12-11-16(25)20(2)17-14-9-10-15(21(12,17)20)24-19(27)22(18(26)23(14)24)13-7-5-4-6-8-13/h4-10,12,14-15,17H,3,11H2,1-2H3/t12-,14+,15-,17-,20+,21+/m0/s1
InChIKey IQFDYDRPHJDPPW-ONMOAQNBSA-N
Mol Weight 363.42 g/mol
Molecular Formula C21H21N3O3
Exact Mass 363.158292 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DdarKKh0Krf
Name (1-R*,3A-R*,3B-S*)-1,2,3B,4-TETRAHYDRO-1-ETHYL-3A-METHYL-7-PHENYL-4,10-ETHENO-6-H,10-H-CYCLOPENTA-[1.3]-CYCLOPROPA-[1.2-D]-[1.2.4]-TRIA
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H21N3O3
InChI InChI=1S/C21H21N3O3/c1-3-12-11-16(25)20(2)17-14-9-10-15(21(12,17)20)24-19(27)22(18(26)23(14)24)13-7-5-4-6-8-13/h4-10,12,14-15,17H,3,11H2,1-2H3/t12-,14+,15-,17-,20+,21+/m0/s1
InChIKey IQFDYDRPHJDPPW-ONMOAQNBSA-N
Literature Reference Author A.R.MAGUIRE,N.R.BUCKLEY,P.O'LEARY,G.FERGUSON
Literature Reference Citation J.CHEM.SOC.PERKIN-1,4077(1998)
Literature Reference DOI 10.1039/a807677d
Molecular Weight 363.416 g/mol
Solvent CDCl3