![N,N-DITHIO-DI-(4,1-PHENYLENE)-BIS-(R)-2,3-BIS-[DI-(TERT.-BUTOXYCARBONYLMETHYL)-AMINO]-PROPANAMIDE](/api/spectrum/6oRcBac5jMu/structure.png?h=300&w=458 "N,N-DITHIO-DI-(4,1-PHENYLENE)-BIS-(R)-2,3-BIS-[DI-(TERT.-BUTOXYCARBONYLMETHYL)-AMINO]-PROPANAMIDE")
| SpectraBase Compound ID | I1BzmiukkpO |
|---|---|
| InChI | InChI=1S/C66H104N6O18S/c1-59(2,3)83-49(73)35-69(36-50(74)84-60(4,5)6)33-47(71(39-53(77)87-63(13,14)15)40-54(78)88-64(16,17)18)57(81)67-43-25-29-45(30-26-43)91-46-31-27-44(28-32-46)68-58(82)48(72(41-55(79)89-65(19,20)21)42-56(80)90-66(22,23)24)34-70(37-51(75)85-61(7,8)9)38-52(76)86-62(10,11)12/h25-32,47-48H,33-42H2,1-24H3,(H,67,81)(H,68,82)/t47-,48+ |
| InChIKey | NYNSYTPHMPNNSE-WPVYDPPMSA-N |
| Mol Weight | 1301.6 g/mol |
| Molecular Formula | C66H104N6O18S |
| Exact Mass | 1300.712782 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6oRcBac5jMu |
|---|---|
| Name | N,N-DITHIO-DI-(4,1-PHENYLENE)-BIS-(R)-2,3-BIS-[DI-(TERT.-BUTOXYCARBONYLMETHYL)-AMINO]-PROPANAMIDE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C66H104N6O18S |
| InChI | InChI=1S/C66H104N6O18S/c1-59(2,3)83-49(73)35-69(36-50(74)84-60(4,5)6)33-47(71(39-53(77)87-63(13,14)15)40-54(78)88-64(16,17)18)57(81)67-43-25-29-45(30-26-43)91-46-31-27-44(28-32-46)68-58(82)48(72(41-55(79)89-65(19,20)21)42-56(80)90-66(22,23)24)34-70(37-51(75)85-61(7,8)9)38-52(76)86-62(10,11)12/h25-32,47-48H,33-42H2,1-24H3,(H,67,81)(H,68,82)/t47-,48+ |
| InChIKey | NYNSYTPHMPNNSE-WPVYDPPMSA-N |
| Literature Reference Author | P.HABERZ,F.RODRIGUEZ-CASTANEDA,J.JUNKER,S.BECKER,A.LEONOV,C. GRIESINGER |
| Literature Reference Citation | ORG.LETTERS,8,1275(2006) |
| Literature Reference DOI | 10.1021/ol053049o |
| Molecular Weight | 1301.641 g/mol |
| Sample ID | 40065 |
| Solvent | CDCl3 |