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

*Links on SpectraBase are not permalinks.

5A-ACETYL-1,3,8,10-TETRACHLORO-5A,6,6A,12A,12B,13-HEXAHYDRO-6-METHYL-7,13-BIS-(4-NITROBENZOYL)-7H-PYRROLO-[2,3-B:4,5-B]-BIS-[1,4]-BENZOXAZINE

View entire compound with spectra: 1 NMR

5A-ACETYL-1,3,8,10-TETRACHLORO-5A,6,6A,12A,12B,13-HEXAHYDRO-6-METHYL-7,13-BIS-(4-NITROBENZOYL)-7H-PYRROLO-[2,3-B:4,5-B]-BIS-[1,4]-BENZOXAZINE
SpectraBase Compound ID 72kkGGvG309
InChI InChI=1S/C33H21Cl4N5O9/c1-15(43)33-29(39(27-23(37)12-19(35)14-25(27)51-33)31(44)16-3-7-20(8-4-16)41(46)47)28-30(38(33)2)40(26-22(36)11-18(34)13-24(26)50-28)32(45)17-5-9-21(10-6-17)42(48)49/h3-14,28-30H,1-2H3
InChIKey QDDOITDSVUEXBN-UHFFFAOYSA-N
Mol Weight 773.4 g/mol
Molecular Formula C33H21Cl4N5O9
Exact Mass 771.009338 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 6yJv5hIawoy
Name 5A-ACETYL-1,3,8,10-TETRACHLORO-5A,6,6A,12A,12B,13-HEXAHYDRO-6-METHYL-7,13-BIS-(4-NITROBENZOYL)-7H-PYRROLO-[2,3-B:4,5-B]-BIS-[1,4]-BENZOXAZINE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H21Cl4N5O9
InChI InChI=1S/C33H21Cl4N5O9/c1-15(43)33-29(39(27-23(37)12-19(35)14-25(27)51-33)31(44)16-3-7-20(8-4-16)41(46)47)28-30(38(33)2)40(26-22(36)11-18(34)13-24(26)50-28)32(45)17-5-9-21(10-6-17)42(48)49/h3-14,28-30H,1-2H3
InChIKey QDDOITDSVUEXBN-UHFFFAOYSA-N
Literature Reference Author H.W.HEINE,M.G.LAPORTE,R.H.OVERBAUGH,E.A.WILLIAMS
Literature Reference Citation HETEROCYCLES,40,743(1995)
Literature Reference DOI 10.3987/COM-94-S62
Molecular Weight 773.370 g/mol
Solvent CDCl3
Source File Reference UWCP5689