| SpectraBase Compound ID | BRduCVnZAxv |
|---|---|
| InChI | InChI=1S/C46H56N14O10S2/c1-21(2)35-45(69)49-17-31(55-41(65)29-15-47-25-11-7-9-13-27(25)53-29)39(63)51-24(6)38(62)58-34-20-72-71-19-33(43(67)59-35)57-37(61)23(5)52-40(64)32(18-50-46(70)36(22(3)4)60-44(34)68)56-42(66)30-16-48-26-12-8-10-14-28(26)54-30/h7-16,21-24,31-36H,17-20H2,1-6H3,(H,49,69)(H,50,70)(H,51,63)(H,52,64)(H,55,65)(H,56,66)(H,57,61)(H,58,62)(H,59,67)(H,60,68)/t23-,24-,31+,32+,33-,34-,35-,36-/m0/s1 |
| InChIKey | IVXKLNOGTROCKI-GOLCXTLISA-N |
| Mol Weight | 1029.2 g/mol |
| Molecular Formula | C46H56N14O10S2 |
| Exact Mass | 1028.374526 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9nCOahXicTz |
|---|---|
| Name | DES-N-(TETRAMETHYL)-AZATRIOSTIN |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H56N14O10S2 |
| InChI | InChI=1S/C46H56N14O10S2/c1-21(2)35-45(69)49-17-31(55-41(65)29-15-47-25-11-7-9-13-27(25)53-29)39(63)51-24(6)38(62)58-34-20-72-71-19-33(43(67)59-35)57-37(61)23(5)52-40(64)32(18-50-46(70)36(22(3)4)60-44(34)68)56-42(66)30-16-48-26-12-8-10-14-28(26)54-30/h7-16,21-24,31-36H,17-20H2,1-6H3,(H,49,69)(H,50,70)(H,51,63)(H,52,64)(H,55,65)(H,56,66)(H,57,61)(H,58,62)(H,59,67)(H,60,68)/t23-,24-,31+,32+,33-,34-,35-,36-/m0/s1 |
| InChIKey | IVXKLNOGTROCKI-GOLCXTLISA-N |
| Literature Reference Author | B.DIETRICH,U.DIEDERICHSEN |
| Literature Reference Citation | EUR.J.ORG.CHEM.,147(2005) |
| Literature Reference DOI | 10.1002/ejoc.200400548 |
| Molecular Weight | 1029.158 g/mol |
| Sample ID | 42253 |
| Solvent | DMSO-D6 |