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N-TRIS-[(2-[[(TRIS-[[2-(TERT.-BUTOXYCARBONYL)-ETHOXY]-METHYL]-METHYL)-AMINO]-CARBONYL]-ETHOXY)-METHYL]-METHYLAMINE
SpectraBase Compound ID 91ssG9sPA7v
InChI InChI=1S/C88H158N4O33/c1-76(2,3)117-67(96)31-43-108-55-86(56-109-44-32-68(97)118-77(4,5)6,57-110-45-33-69(98)119-78(7,8)9)90-64(93)28-40-105-52-85(89,53-106-41-29-65(94)91-87(58-111-46-34-70(99)120-79(10,11)12,59-112-47-35-71(100)121-80(13,14)15)60-113-48-36-72(101)122-81(16,17)18)54-107-42-30-66(95)92-88(61-114-49-37-73(102)123-82(19,20)21,62-115-50-38-74(103)124-83(22,23)24)63-116-51-39-75(104)125-84(25,26)27/h28-63,89H2,1-27H3,(H,90,93)(H,91,94)(H,92,95)
InChIKey DSXQSWOMAKDHQJ-UHFFFAOYSA-N
Mol Weight 1800.2 g/mol
Molecular Formula C88H158N4O33
Exact Mass 1799.080834 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9XLYSfYjxy
Name N-TRIS-[(2-[[(TRIS-[[2-(TERT.-BUTOXYCARBONYL)-ETHOXY]-METHYL]-METHYL)-AMINO]-CARBONYL]-ETHOXY)-METHYL]-METHYLAMINE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C88H158N4O33
InChI InChI=1S/C88H158N4O33/c1-76(2,3)117-67(96)31-43-108-55-86(56-109-44-32-68(97)118-77(4,5)6,57-110-45-33-69(98)119-78(7,8)9)90-64(93)28-40-105-52-85(89,53-106-41-29-65(94)91-87(58-111-46-34-70(99)120-79(10,11)12,59-112-47-35-71(100)121-80(13,14)15)60-113-48-36-72(101)122-81(16,17)18)54-107-42-30-66(95)92-88(61-114-49-37-73(102)123-82(19,20)21,62-115-50-38-74(103)124-83(22,23)24)63-116-51-39-75(104)125-84(25,26)27/h28-63,89H2,1-27H3,(H,90,93)(H,91,94)(H,92,95)
InChIKey DSXQSWOMAKDHQJ-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 1800.230 g/mol
Solvent ACETONE-D6
Source File Reference UWLU24874