John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=2IvBlZiyYsp SpectraBase Spectrum ID=28mgHwZ2N6e

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[4-[2-[4-[2-(4-ethynylphenyl)ethynyl]phenyl]ethynyl]phenyl]-dilauryl-amine
SpectraBase Compound ID 2IvBlZiyYsp
InChI InChI=1S/C48H63N/c1-4-7-9-11-13-15-17-19-21-23-41-49(42-24-22-20-18-16-14-12-10-8-5-2)48-39-37-47(38-40-48)36-35-46-33-31-45(32-34-46)30-29-44-27-25-43(6-3)26-28-44/h3,25-28,31-34,37-40H,4-5,7-24,41-42H2,1-2H3
InChIKey SGHAKYIIGBOHDT-UHFFFAOYSA-N
Mol Weight 654.0 g/mol
Molecular Formula C48H63N
Exact Mass 653.496051 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 28mgHwZ2N6e
Name [4-[2-[4-[2-(4-ethynylphenyl)ethynyl]phenyl]ethynyl]phenyl]-dilauryl-amine
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H63N
InChI InChI=1S/C48H63N/c1-4-7-9-11-13-15-17-19-21-23-41-49(42-24-22-20-18-16-14-12-10-8-5-2)48-39-37-47(38-40-48)36-35-46-33-31-45(32-34-46)30-29-44-27-25-43(6-3)26-28-44/h3,25-28,31-34,37-40H,4-5,7-24,41-42H2,1-2H3
InChIKey SGHAKYIIGBOHDT-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 654.035 g/mol
Source File Reference MHKO20452
SpectraBase Batch ID 3R6xgBvTQaY