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#19;2-[[(DIMETHOXYPHOSPHORYL)-METHOXYCARBONYLMETHYL]-CARBAMOYL]-3A-(1,1-DIMETHYLALLYL)-2,3,3A,8A-TETRAHYDROPYRROLO-[2,3-B]-INDOLE-1,8-DICARBOXYIC-ACID-DI-TERT.
SpectraBase Compound ID EAtoHWFqFOW
InChI InChI=1S/C31H46N3O10P/c1-13-30(8,9)31-18-21(22(35)32-23(24(36)40-10)45(39,41-11)42-12)34(27(38)44-29(5,6)7)25(31)33(26(37)43-28(2,3)4)20-17-15-14-16-19(20)31/h13-17,21,23,25H,1,18H2,2-12H3,(H,32,35)/t21-,23?,25?,31+/m1/s1
InChIKey YOXJXSHNIOYCGT-DMPQRPCESA-N
Mol Weight 651.7 g/mol
Molecular Formula C31H46N3O10P
Exact Mass 651.292082 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B9BYLxICqHO
Name #19;2-[[(DIMETHOXYPHOSPHORYL)-METHOXYCARBONYLMETHYL]-CARBAMOYL]-3A-(1,1-DIMETHYLALLYL)-2,3,3A,8A-TETRAHYDROPYRROLO-[2,3-B]-INDOLE-1,8-DICARBOXYIC-ACID-DI-TERT.
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H46N3O10P
InChI InChI=1S/C31H46N3O10P/c1-13-30(8,9)31-18-21(22(35)32-23(24(36)40-10)45(39,41-11)42-12)34(27(38)44-29(5,6)7)25(31)33(26(37)43-28(2,3)4)20-17-15-14-16-19(20)31/h13-17,21,23,25H,1,18H2,2-12H3,(H,32,35)/t21-,23?,25?,31+/m1/s1
InChIKey YOXJXSHNIOYCGT-DMPQRPCESA-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 651.694 g/mol
Solvent CDCl3
Source File Reference UWMS23165