![BENZYL-N-TRIS-[(2-[[(TRIS-[[2-(TERT.-BUTOXYCARBONYL)-ETHOXY]-METHYL]-METHYL)-AMINO]-CARBONYL]-ETHOXY)-METHYL]-METHYLCARBAMATE](/api/spectrum/JJ2UC3RbTD0/structure.png?h=300&w=458 "BENZYL-N-TRIS-[(2-[[(TRIS-[[2-(TERT.-BUTOXYCARBONYL)-ETHOXY]-METHYL]-METHYL)-AMINO]-CARBONYL]-ETHOXY)-METHYL]-METHYLCARBAMATE")
| SpectraBase Compound ID | FQovRTl8qnn |
|---|---|
| InChI | InChI=1S/C96H164N4O35/c1-84(2,3)127-74(104)36-48-117-58-93(59-118-49-37-75(105)128-85(4,5)6,60-119-50-38-76(106)129-86(7,8)9)97-71(101)33-45-114-67-96(100-83(113)126-57-70-31-29-28-30-32-70,68-115-46-34-72(102)98-94(61-120-51-39-77(107)130-87(10,11)12,62-121-52-40-78(108)131-88(13,14)15)63-122-53-41-79(109)132-89(16,17)18)69-116-47-35-73(103)99-95(64-123-54-42-80(110)133-90(19,20)21,65-124-55-43-81(111)134-91(22,23)24)66-125-56-44-82(112)135-92(25,26)27/h28-32H,33-69H2,1-27H3,(H,97,101)(H,98,102)(H,99,103)(H,100,113) |
| InChIKey | UYTGHSHBOXRAEW-UHFFFAOYSA-N |
| Mol Weight | 1934.4 g/mol |
| Molecular Formula | C96H164N4O35 |
| Exact Mass | 1933.117613 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JJ2UC3RbTD0 |
|---|---|
| Name | BENZYL-N-TRIS-[(2-[[(TRIS-[[2-(TERT.-BUTOXYCARBONYL)-ETHOXY]-METHYL]-METHYL)-AMINO]-CARBONYL]-ETHOXY)-METHYL]-METHYLCARBAMATE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C96H164N4O35 |
| InChI | InChI=1S/C96H164N4O35/c1-84(2,3)127-74(104)36-48-117-58-93(59-118-49-37-75(105)128-85(4,5)6,60-119-50-38-76(106)129-86(7,8)9)97-71(101)33-45-114-67-96(100-83(113)126-57-70-31-29-28-30-32-70,68-115-46-34-72(102)98-94(61-120-51-39-77(107)130-87(10,11)12,62-121-52-40-78(108)131-88(13,14)15)63-122-53-41-79(109)132-89(16,17)18)69-116-47-35-73(103)99-95(64-123-54-42-80(110)133-90(19,20)21,65-124-55-43-81(111)134-91(22,23)24)66-125-56-44-82(112)135-92(25,26)27/h28-32H,33-69H2,1-27H3,(H,97,101)(H,98,102)(H,99,103)(H,100,113) |
| InChIKey | UYTGHSHBOXRAEW-UHFFFAOYSA-N |
| Literature Reference Author | C.M.CARDONA,R.E.GAWLEY |
| Literature Reference Citation | J.ORG.CHEM.,67,1411(2002) |
| Literature Reference DOI | 10.1021/jo0161678 |
| Molecular Weight | 1934.364 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU24873 |