![N-[(3S)-4-[(TERT.-BUTYLDIMETHYLSILYL)-OXY]-3-[[(4-METHYLPHENYL)-SULFONYL]-AMINO]-BUTYL]-N'-[(2R)-1-[(TERT.-BUTYLDIPHENYLSILYL)-OXY]-5-THIAHEX-2-YL]-THIOUREA](/api/spectrum/IVshYgkgsCM/structure.png?h=300&w=458 "N-[(3S)-4-[(TERT.-BUTYLDIMETHYLSILYL)-OXY]-3-[[(4-METHYLPHENYL)-SULFONYL]-AMINO]-BUTYL]-N'-[(2R)-1-[(TERT.-BUTYLDIPHENYLSILYL)-OXY]-5-THIAHEX-2-YL]-THIOUREA")
| SpectraBase Compound ID | R1Cu6GL48B |
|---|---|
| InChI | InChI=1S/C39H61N3O4S3Si2/c1-31-21-23-34(24-22-31)49(43,44)42-33(30-45-50(9,10)38(2,3)4)25-27-40-37(47)41-32(26-28-48-8)29-46-51(39(5,6)7,35-17-13-11-14-18-35)36-19-15-12-16-20-36/h11-24,32-33,42H,25-30H2,1-10H3,(H2,40,41,47)/t32?,33-/m1/s1 |
| InChIKey | FNFWNGYKWVKHTM-ZHZZGXISSA-N |
| Mol Weight | 788.3 g/mol |
| Molecular Formula | C39H61N3O4S3Si2 |
| Exact Mass | 787.336274 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IVshYgkgsCM |
|---|---|
| Name | N-[(3S)-4-[(TERT.-BUTYLDIMETHYLSILYL)-OXY]-3-[[(4-METHYLPHENYL)-SULFONYL]-AMINO]-BUTYL]-N'-[(2R)-1-[(TERT.-BUTYLDIPHENYLSILYL)-OXY]-5-THIAHEX-2-YL]-THIOUREA |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H61N3O4S3Si2 |
| InChI | InChI=1S/C39H61N3O4S3Si2/c1-31-21-23-34(24-22-31)49(43,44)42-33(30-45-50(9,10)38(2,3)4)25-27-40-37(47)41-32(26-28-48-8)29-46-51(39(5,6)7,35-17-13-11-14-18-35)36-19-15-12-16-20-36/h11-24,32-33,42H,25-30H2,1-10H3,(H2,40,41,47)/t32?,33-/m1/s1 |
| InChIKey | FNFWNGYKWVKHTM-ZHZZGXISSA-N |
| Literature Reference Author | H.KURZMEIER,F.P.SCHMIDTCHEN |
| Literature Reference Citation | J.ORG.CHEM.,55,3749(1990) |
| Literature Reference DOI | 10.1021/jo00299a013 |
| Molecular Weight | 788.282 g/mol |
| Solvent | CD3CN |
| Source File Reference | UWED15136 |