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

*Links on SpectraBase are not permalinks.

#21;2-[2-(1-ORTHO-NITROBENZYL-1H-IMIDAZOL-4-YL)-1-METHOXYCARBONYL-VINYLCARBAMOYL]-3A-(1,1-DIMETHYLALLYL)-2,3,3A,8A-TETRAHYDROPYRROLO-[2,3-B]-INDOLE-1,8-DICARBO

View entire compound with spectra: 1 NMR

#21;2-[2-(1-ORTHO-NITROBENZYL-1H-IMIDAZOL-4-YL)-1-METHOXYCARBONYL-VINYLCARBAMOYL]-3A-(1,1-DIMETHYLALLYL)-2,3,3A,8A-TETRAHYDROPYRROLO-[2,3-B]-INDOLE-1,8-DICARBO
SpectraBase Compound ID CsM9rnpAE8b
InChI InChI=1S/C40H48N6O9/c1-11-39(8,9)40-21-31(32(47)42-28(33(48)53-10)20-26-23-43(24-41-26)22-25-16-12-14-18-29(25)46(51)52)45(36(50)55-38(5,6)7)34(40)44(35(49)54-37(2,3)4)30-19-15-13-17-27(30)40/h11-20,23-24,31,34H,1,21-22H2,2-10H3,(H,42,47)/b28-20+/t31-,34?,40+/m1/s1
InChIKey NKOGCIFZIMSKDY-BRNVQQIMSA-N
Mol Weight 756.9 g/mol
Molecular Formula C40H48N6O9
Exact Mass 756.348277 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 BKj1fTvYKk4
Name #21;2-[2-(1-ORTHO-NITROBENZYL-1H-IMIDAZOL-4-YL)-1-METHOXYCARBONYL-VINYLCARBAMOYL]-3A-(1,1-DIMETHYLALLYL)-2,3,3A,8A-TETRAHYDROPYRROLO-[2,3-B]-INDOLE-1,8-DICARBO
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H48N6O9
InChI InChI=1S/C40H48N6O9/c1-11-39(8,9)40-21-31(32(47)42-28(33(48)53-10)20-26-23-43(24-41-26)22-25-16-12-14-18-29(25)46(51)52)45(36(50)55-38(5,6)7)34(40)44(35(49)54-37(2,3)4)30-19-15-13-17-27(30)40/h11-20,23-24,31,34H,1,21-22H2,2-10H3,(H,42,47)/b28-20+/t31-,34?,40+/m1/s1
InChIKey NKOGCIFZIMSKDY-BRNVQQIMSA-N
Literature Reference Author B.M.SCHIAVI,D.J.RICHARD,M.M.JOULLIE
Literature Reference Citation J.ORG.CHEM.,67,620(2002)
Literature Reference DOI 10.1021/jo0106593
Molecular Weight 756.856 g/mol
Solvent CDCl3
Source File Reference UWMS23164