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DIMETHYL-4-CYANO-4-METHOXYCARBONYL-2,6-BIS-[N-(4-METHOXYCARBONYLPHENYL)-AMINOMETHYL]-HEPTANODIOATE

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DIMETHYL-4-CYANO-4-METHOXYCARBONYL-2,6-BIS-[N-(4-METHOXYCARBONYLPHENYL)-AMINOMETHYL]-HEPTANODIOATE
SpectraBase Compound ID 6EZIUzCz3JB
InChI InChI=1S/2C30H35N3O10/c2*1-39-25(34)19-6-10-23(11-7-19)32-16-21(27(36)41-3)14-30(18-31,29(38)43-5)15-22(28(37)42-4)17-33-24-12-8-20(9-13-24)26(35)40-2/h2*6-13,21-22,32-33H,14-17H2,1-5H3
InChIKey FTWUVZJBCVEWGP-UHFFFAOYSA-N
Mol Weight 1195.2 g/mol
Molecular Formula C60H70N6O20
Exact Mass 1194.464489 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4UTchqrm2Sp
Name DIMETHYL-4-CYANO-4-METHOXYCARBONYL-2,6-BIS-[N-(4-METHOXYCARBONYLPHENYL)-AMINOMETHYL]-HEPTANODIOATE
Compound Number 19B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C60H70N6O20
InChI InChI=1S/2C30H35N3O10/c2*1-39-25(34)19-6-10-23(11-7-19)32-16-21(27(36)41-3)14-30(18-31,29(38)43-5)15-22(28(37)42-4)17-33-24-12-8-20(9-13-24)26(35)40-2/h2*6-13,21-22,32-33H,14-17H2,1-5H3
InChIKey FTWUVZJBCVEWGP-UHFFFAOYSA-N
Literature Reference Author J.I.BORRELL,J.TEIXIDO,J.L.MATALLANA,B.MARTINEZ-TEIPEL,C.COLO MINAS,M.COSTA,M.BALC
Literature Reference Citation J.MED.CHEM.,44,2366(2001)
Literature Reference DOI 10.1021/jm990411u
Molecular Weight 1195.244 g/mol
Sample ID 44629
Solvent CDCl3