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#9;[(1''S,2''R,4''R)-N,N-DIISOPROPYLBORNAN-10''-SULFONAMIDE-2''-YL]-2-[(1'-ALPHA-ETHYL-1',2',3',4',6',7',12',12B'-ALPHA-OCTAHYDROINDOLO-[2',3'-A]-QUINOLIZIN-
SpectraBase Compound ID GGUJM2e63jl
InChI InChI=1S/C37H55N3O6S/c1-8-36(16-11-18-39-19-15-27-26-12-9-10-13-29(26)38-31(27)32(36)39)21-28(33(41)42)34(43)46-30-20-25-14-17-37(30,35(25,6)7)22-47(44,45)40(23(2)3)24(4)5/h9-10,12-13,23-25,28,30,32,38H,8,11,14-22H2,1-7H3,(H,41,42)/t25-,28?,30-,32-,36+,37-/m1/s1
InChIKey YNKUMHGKUYTALO-YHMNVGSOSA-N
Mol Weight 669.9 g/mol
Molecular Formula C37H55N3O6S
Exact Mass 669.381158 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CVbBRg4fj4E
Name #9;[(1''S,2''R,4''R)-N,N-DIISOPROPYLBORNAN-10''-SULFONAMIDE-2''-YL]-2-[(1'-ALPHA-ETHYL-1',2',3',4',6',7',12',12B'-ALPHA-OCTAHYDROINDOLO-[2',3'-A]-QUINOLIZIN-
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H55N3O6S
InChI InChI=1S/C37H55N3O6S/c1-8-36(16-11-18-39-19-15-27-26-12-9-10-13-29(26)38-31(27)32(36)39)21-28(33(41)42)34(43)46-30-20-25-14-17-37(30,35(25,6)7)22-47(44,45)40(23(2)3)24(4)5/h9-10,12-13,23-25,28,30,32,38H,8,11,14-22H2,1-7H3,(H,41,42)/t25-,28?,30-,32-,36+,37-/m1/s1
InChIKey YNKUMHGKUYTALO-YHMNVGSOSA-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 669.920 g/mol
Solvent CDCl3
Source File Reference UWCP5728