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#8C;(+/-)-(3A-A,6-A,7-B,7A-B,7B-A)-N,N-DIETHYLOCTAHYDRO-7-(2-METHOXYNAPHTHALENYL)-6-METHYL-1,3-DIOXO-2-PHENYLAZETO-[1,2-B]-PYRROLO-[3,4-D]-ISOXAZOLE-6-CARBOXAM
SpectraBase Compound ID C74rHnzRWG
InChI InChI=1S/C30H31N3O5/c1-5-31(6-2)29(36)30(3)24(22-20-15-11-10-12-18(20)16-17-21(22)37-4)25-23-26(38-33(25)30)28(35)32(27(23)34)19-13-8-7-9-14-19/h7-17,23-26H,5-6H2,1-4H3/t23-,24+,25+,26+,30+/m0/s1
InChIKey MENDVBPSMNHABE-KCIRMXFQSA-N
Mol Weight 513.59 g/mol
Molecular Formula C30H31N3O5
Exact Mass 513.226371 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 339fI3npkNS
Name #8C;(+/-)-(3A-A,6-A,7-B,7A-B,7B-A)-N,N-DIETHYLOCTAHYDRO-7-(2-METHOXYNAPHTHALENYL)-6-METHYL-1,3-DIOXO-2-PHENYLAZETO-[1,2-B]-PYRROLO-[3,4-D]-ISOXAZOLE-6-CARBOXAM
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H31N3O5
InChI InChI=1S/C30H31N3O5/c1-5-31(6-2)29(36)30(3)24(22-20-15-11-10-12-18(20)16-17-21(22)37-4)25-23-26(38-33(25)30)28(35)32(27(23)34)19-13-8-7-9-14-19/h7-17,23-26H,5-6H2,1-4H3/t23-,24+,25+,26+,30+/m0/s1
InChIKey MENDVBPSMNHABE-KCIRMXFQSA-N
Literature Reference Author P.J.S.S.VAN-EIJK,W.VERBOOM,F.C.J.M.VAN-VEGGEL,D.N.REINHOUDT, S.HARKEMA
Literature Reference Citation REC.TR.CH.P.-B.,107,142(1988)
Literature Reference DOI 10.1002/recl.19881070308
Molecular Weight 513.593 g/mol
Solvent CDCl3
Source File Reference UNIW21159