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

*Links on SpectraBase are not permalinks.
#39;(1R*,5S*,9S*)-9-(2-[3-METHYL-2,5-DIOXOPYRROLIDIN-1-YL]-BENZOYL)-3-(3-PHENYLPROPYL)-3-AZABICYCLO-[3.3.1]-NON-1-YLMETHYL-2-(3-METHYL-2,5-DIOXOPYRROLIDIN-1-YL
SpectraBase Compound ID AYhwcT6DOfg
InChI InChI=1S/C42H45N3O8/c1-27-22-35(46)44(38(27)48)33-18-8-6-16-31(33)40(50)52-26-42-20-10-15-30(24-43(25-42)21-11-14-29-12-4-3-5-13-29)37(42)53-41(51)32-17-7-9-19-34(32)45-36(47)23-28(2)39(45)49/h3-9,12-13,16-19,27-28,30,37H,10-11,14-15,20-26H2,1-2H3/t27?,28?,30-,37+,42-/m1/s1
InChIKey SMOXBSOKYBCFFY-NZGBNHDWSA-N
Mol Weight 719.8 g/mol
Molecular Formula C42H45N3O8
Exact Mass 719.320665 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 Gis5GLYnbhB
Name #39;(1R*,5S*,9S*)-9-(2-[3-METHYL-2,5-DIOXOPYRROLIDIN-1-YL]-BENZOYL)-3-(3-PHENYLPROPYL)-3-AZABICYCLO-[3.3.1]-NON-1-YLMETHYL-2-(3-METHYL-2,5-DIOXOPYRROLIDIN-1-YL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H45N3O8
InChI InChI=1S/C42H45N3O8/c1-27-22-35(46)44(38(27)48)33-18-8-6-16-31(33)40(50)52-26-42-20-10-15-30(24-43(25-42)21-11-14-29-12-4-3-5-13-29)37(42)53-41(51)32-17-7-9-19-34(32)45-36(47)23-28(2)39(45)49/h3-9,12-13,16-19,27-28,30,37H,10-11,14-15,20-26H2,1-2H3/t27?,28?,30-,37+,42-/m1/s1
InChIKey SMOXBSOKYBCFFY-NZGBNHDWSA-N
Literature Reference Author M.A.BRIMBLE,C.BROCKE
Literature Reference Citation EUR.J.ORG.CHEM.,2385(2005)
Molecular Weight 719.835 g/mol
Sample ID 39446
Solvent CDCl3