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

*Links on SpectraBase are not permalinks.

REL-(2R,6R,7S,8R,9R)-3,6-DIHYDROXY-9-METHYLDODECAHYDROBENZOINDOL-2-ONE

View entire compound with spectra: 2 NMR

REL-(2R,6R,7S,8R,9R)-3,6-DIHYDROXY-9-METHYLDODECAHYDROBENZOINDOL-2-ONE
SpectraBase Compound ID HEZ1v2dlsbg
InChI InChI=1S/2C13H21NO3/c2*1-13-8-5-3-2-4-7(8)10(15)6-9(13)11(16)12(17)14-13/h2*7-11,15-16H,2-6H2,1H3,(H,14,17)/t2*7-,8-,9?,10-,11+,13-/m00/s1
InChIKey RTONXGFAOPIDKE-RMFRGBQDSA-N
Mol Weight 478.63 g/mol
Molecular Formula C26H42N2O6
Exact Mass 478.304287 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 Q8oEvJlaEV
Name REL-(2R,6R,7S,8R,9R)-3,6-DIHYDROXY-9-METHYL-DODECAHYDROBENZOINDOL-2-ONE
Compound Number 49
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H42N2O6
InChI InChI=1S/2C13H21NO3/c2*1-13-8-5-3-2-4-7(8)10(15)6-9(13)11(16)12(17)14-13/h2*7-11,15-16H,2-6H2,1H3,(H,14,17)/t2*7-,8-,9?,10-,11+,13-/m00/s1
InChIKey RTONXGFAOPIDKE-RMFRGBQDSA-N
Literature Reference Author S.E.DENMARK,L.GOMEZ
Literature Reference Citation J.ORG.CHEM.,68,8015(2003)
Literature Reference DOI 10.1021/jo034853w
Molecular Weight 478.629 g/mol
Solvent CDCl3
Source File Reference UWVN20737