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#6;14-ETHOXYCARBONYL-14-[(1'S,2'R,4'R)-N,N-DIISOPROPYLBORNAN-10'-SULFONAMID-2'-OXYCARBONYL]-1-ALPHA-ETHYL-1,2,3,4,6,7,12,12B-OCTAHYDROINDOLO-[2,3-A]-
SpectraBase Compound ID JQaDGD41n2T
InChI InChI=1S/C40H59N3O7S/c1-9-37-18-13-20-42-21-17-30-29-14-11-12-15-31(29)41-33(30)40(37,42)49-24-38(23-37,34(44)48-10-2)35(45)50-32-22-28-16-19-39(32,36(28,7)8)25-51(46,47)43(26(3)4)27(5)6/h11-12,14-15,26-28,32,41H,9-10,13,16-25H2,1-8H3/t28-,32-,37+,38?,39-,40-/m1/s1
InChIKey SFTAOCVTEZVYTG-IQCPBXKMSA-N
Mol Weight 726.0 g/mol
Molecular Formula C40H59N3O7S
Exact Mass 725.407372 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KgEY9FSi2XE
Name #6;14-ETHOXYCARBONYL-14-[(1'S,2'R,4'R)-N,N-DIISOPROPYLBORNAN-10'-SULFONAMID-2'-OXYCARBONYL]-1-ALPHA-ETHYL-1,2,3,4,6,7,12,12B-OCTAHYDROINDOLO-[2,3-A]-
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H59N3O7S
InChI InChI=1S/C40H59N3O7S/c1-9-37-18-13-20-42-21-17-30-29-14-11-12-15-31(29)41-33(30)40(37,42)49-24-38(23-37,34(44)48-10-2)35(45)50-32-22-28-16-19-39(32,36(28,7)8)25-51(46,47)43(26(3)4)27(5)6/h11-12,14-15,26-28,32,41H,9-10,13,16-25H2,1-8H3/t28-,32-,37+,38?,39-,40-/m1/s1
InChIKey SFTAOCVTEZVYTG-IQCPBXKMSA-N
Literature Reference Author T.NAGY,L.SZABO,G.KALAUS,C.SZANTAY
Literature Reference Citation HETEROCYCLES,45,2007(1997)
Literature Reference DOI 10.3987/COM-97-7884
Molecular Weight 725.984 g/mol
Solvent CDCl3
Source File Reference UWCP5725