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KKEGSPZXDJOECT-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

KKEGSPZXDJOECT-UHFFFAOYSA-N
SpectraBase Compound ID 9dLMbwrSMgX
InChI InChI=1S/C56H78N4O6/c1-53(2,3)43-25-35-21-39-29-45(55(7,8)9)31-41-23-37-27-44(54(4,5)6)28-38(50(37)64)24-42-32-46(56(10,11)12)30-40(22-36(26-43)49(35)63)52(42)66-34-48(62)60-18-14-16-58-20-19-57-15-13-17-59-47(61)33-65-51(39)41/h25-32,57-58,63-64H,13-24,33-34H2,1-12H3,(H,59,61)(H,60,62)
InChIKey KKEGSPZXDJOECT-UHFFFAOYSA-N
Mol Weight 903.3 g/mol
Molecular Formula C56H78N4O6
Exact Mass 902.592136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5ZpAPrAKgUc
Name KKEGSPZXDJOECT-UHFFFAOYSA-N
Compound Number 6E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C56H78N4O6
InChI InChI=1S/C56H78N4O6/c1-53(2,3)43-25-35-21-39-29-45(55(7,8)9)31-41-23-37-27-44(54(4,5)6)28-38(50(37)64)24-42-32-46(56(10,11)12)30-40(22-36(26-43)49(35)63)52(42)66-34-48(62)60-18-14-16-58-20-19-57-15-13-17-59-47(61)33-65-51(39)41/h25-32,57-58,63-64H,13-24,33-34H2,1-12H3,(H,59,61)(H,60,62)
InChIKey KKEGSPZXDJOECT-UHFFFAOYSA-N
Literature Reference Author R.OSTASZEWSKI,T.W.STEVENS,W.VERBOOM,D.N.REINHOUDT,F.M.KASPER SEN
Literature Reference Citation REC.TR.CH.P.-B.,110,294(1991)
Literature Reference DOI 10.1002/recl.19911100608
Molecular Weight 903.259 g/mol
Solvent CDCl3
Source File Reference UWCS21187