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ETHYL-(1S*,7R*,8R*)-7-HYDROXY-10-(3-PHENYLPROPYL)-10-AZATRICYCLO-[6.3.3.0(1,7)]-TETRADEC-4-ENE-8-CARBOXYLATE
SpectraBase Compound ID HX0OUQVfNDb
InChI InChI=1S/C25H35NO3/c1-2-29-22(27)24-16-10-15-23(14-7-4-8-17-25(23,24)28)19-26(20-24)18-9-13-21-11-5-3-6-12-21/h3-6,8,11-12,28H,2,7,9-10,13-20H2,1H3/t23-,24+,25-/m1/s1
InChIKey CYFWQFWKZLSGIO-DSNGMDLFSA-N
Mol Weight 397.6 g/mol
Molecular Formula C25H35NO3
Exact Mass 397.261694 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 53sBidMNA1v
Name ETHYL-(1S*,7R*,8R*)-7-HYDROXY-10-(3-PHENYLPROPYL)-10-AZATRICYCLO-[6.3.3.0(1,7)]-TETRADEC-4-ENE-8-CARBOXYLATE
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H35NO3
InChI InChI=1S/C25H35NO3/c1-2-29-22(27)24-16-10-15-23(14-7-4-8-17-25(23,24)28)19-26(20-24)18-9-13-21-11-5-3-6-12-21/h3-6,8,11-12,28H,2,7,9-10,13-20H2,1H3/t23-,24+,25-/m1/s1
InChIKey CYFWQFWKZLSGIO-DSNGMDLFSA-N
Literature Reference Author A.LEHMANN,C.BROCKE,D.BARKER,M.A.BRIMBLE
Literature Reference Citation EUR.J.ORG.CHEM.,3205(2006)
Molecular Weight 397.558 g/mol
Sample ID 31811
Solvent CDCl3