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METHYL-(2S,3AR,6R,7AR)-1-BENZYL-6-HYDROXYOCTAHYDROINDOLE-2-CARBOXYLATE
SpectraBase Compound ID 2CmKCZtDNSu
InChI InChI=1S/C17H23NO3/c1-21-17(20)16-9-13-7-8-14(19)10-15(13)18(16)11-12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14-,15-,16+/m1/s1
InChIKey CRKDJTMHMPQZPT-FPCVCCKLSA-N
Mol Weight 289.38 g/mol
Molecular Formula C17H23NO3
Exact Mass 289.167794 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kp9No8HBMED
Name METHYL-(2S,3AR,6R,7AR)-1-BENZYL-6-HYDROXYOCTAHYDROINDOLE-2-CARBOXYLATE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H23NO3
InChI InChI=1S/C17H23NO3/c1-21-17(20)16-9-13-7-8-14(19)10-15(13)18(16)11-12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14-,15-,16+/m1/s1
InChIKey CRKDJTMHMPQZPT-FPCVCCKLSA-N
Literature Reference Author N.VALLS,M.VALLRIBERA,S.CARMELI,J.BONJOCH
Literature Reference Citation ORG.LETTERS,5,447(2003)
Literature Reference DOI 10.1021/ol0273250
Molecular Weight 289.375 g/mol
Sample ID 49436
Solvent CDCl3