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

*Links on SpectraBase are not permalinks.
7,8-DI-(4-METHOXYPHENYL)-1,3-DIAZETO-[1',2'-A]-PYRAZOLO-[3,4-D]-[1,3]-DIAZEPINE
SpectraBase Compound ID El8rCXxpetM
InChI InChI=1S/C31H28N6O4/c1-5-41-29(38)27-19-26-20(2)34-37(23-9-7-6-8-10-23)28(26)33-31-35(22-13-17-25(40-4)18-14-22)30(36(27)31)32-21-11-15-24(39-3)16-12-21/h6-19H,5H2,1-4H3/b32-30+
InChIKey NVKINSAJRYKTHX-NHQGMKOOSA-N
Mol Weight 548.6 g/mol
Molecular Formula C31H28N6O4
Exact Mass 548.217203 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 K219BDlWsXR
Name 7,8-DI-(4-METHOXYPHENYL)-1,3-DIAZETO-[1',2'-A]-PYRAZOLO-[3,4-D]-[1,3]-DIAZEPINE
Compound Number 4C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H28N6O4
InChI InChI=1S/C31H28N6O4/c1-5-41-29(38)27-19-26-20(2)34-37(23-9-7-6-8-10-23)28(26)33-31-35(22-13-17-25(40-4)18-14-22)30(36(27)31)32-21-11-15-24(39-3)16-12-21/h6-19H,5H2,1-4H3/b32-30+
InChIKey NVKINSAJRYKTHX-NHQGMKOOSA-N
Literature Reference Author P.MOLINA,A.ARQUES,A.ALIAS
Literature Reference Citation J.ORG.CHEM.,58,5264(1993)
Literature Reference DOI 10.1021/jo00071a043
Molecular Weight 548.601 g/mol
Solvent CDCl3
Source File Reference UWCS22354