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

*Links on SpectraBase are not permalinks.
3-(4-BENZYLOXY-3-METHOXYPHENYL)-2-METHYL-5-PHENYLTETRAHYDROPYRROLO-[3,4-D]-ISOXAZOL-4,6-DIONE
SpectraBase Compound ID 5TtH6AAJxa7
InChI InChI=1S/2C26H24N2O5/c1-27-23(22-24(33-27)26(30)28(25(22)29)19-9-5-3-6-10-19)17-13-14-18(21(15-17)31-2)16-32-20-11-7-4-8-12-20;1-27-23(22-24(33-27)26(30)28(25(22)29)19-11-7-4-8-12-19)18-13-14-20(21(15-18)31-2)32-16-17-9-5-3-6-10-17/h2*3-15,22-24H,16H2,1-2H3/t2*22-,23-,24+/m01/s1
InChIKey QAWHHKPAHLJQMT-HGARUWRYSA-N
Mol Weight 888.97 g/mol
Molecular Formula C52H48N4O10
Exact Mass 888.337044 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 Ge1vC4qFfwk
Name 3-(4-BENZYLOXY-3-METHOXYPHENYL)-2-METHYL-5-PHENYLTETRAHYDROPYRROLO-[3,4-D]-ISOXAZOL-4,6-DIONE
Compound Number 3B -TRANS
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H48N4O10
InChI InChI=1S/2C26H24N2O5/c1-27-23(22-24(33-27)26(30)28(25(22)29)19-9-5-3-6-10-19)17-13-14-18(21(15-17)31-2)16-32-20-11-7-4-8-12-20;1-27-23(22-24(33-27)26(30)28(25(22)29)19-11-7-4-8-12-19)18-13-14-20(21(15-18)31-2)32-16-17-9-5-3-6-10-17/h2*3-15,22-24H,16H2,1-2H3/t2*22-,23-,24+/m01/s1
InChIKey QAWHHKPAHLJQMT-HGARUWRYSA-N
Literature Reference Author K.PIHLAJA,P.TAEHTINEN,R.SHAKHUTDINOV,H.HARTIKAINEN,V.OVCHARE NKO,H.AGIRBAS,S.GUEN
Literature Reference Citation J.HETCYCL.CHEM.,41,741(2004)
Literature Reference DOI 10.1002/jhet.5570410515
Molecular Weight 888.974 g/mol
Solvent CDCl3
Source File Reference UWLU22476