For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
N-(3,6,9)-TRIPROPYL-12-AMINO-(4S)-METHYL-(7S)-BENZYL-3,6,9-TRIAZAUNDECANE-TETRAKIS-(TRIFLUOROACETATIC-ACID)-SALT
SpectraBase Compound ID BqJ3V9hvlZ
InChI InChI=1S/C26H50N4.4C2HF3O2/c1-6-17-28(20-13-16-27)23-26(21-25-14-11-10-12-15-25)30(19-8-3)22-24(5)29(9-4)18-7-2;4*3-2(4,5)1(6)7/h10-12,14-15,24,26H,6-9,13,16-23,27H2,1-5H3;4*(H,6,7)/t24-,26-;;;;/m0..../s1
InChIKey GIDNAKVHJWLCAS-NLQMLDHLSA-N
Mol Weight 874.807 g/mol
Molecular Formula C34H54F12N4O8
Exact Mass 874.375003 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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 Ca5Sc73qAbm
Name N-(3,6,9)-TRIPROPYL-12-AMINO-(4S)-METHYL-(7S)-BENZYL-3,6,9-TRIAZAUNDECANE-TETRAKIS-(TRIFLUOROACETATIC-ACID)-SALT
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H54F12N4O8
InChI InChI=1S/C26H50N4.4C2HF3O2/c1-6-17-28(20-13-16-27)23-26(21-25-14-11-10-12-15-25)30(19-8-3)22-24(5)29(9-4)18-7-2;4*3-2(4,5)1(6)7/h10-12,14-15,24,26H,6-9,13,16-23,27H2,1-5H3;4*(H,6,7)/t24-,26-;;;;/m0..../s1
InChIKey GIDNAKVHJWLCAS-NLQMLDHLSA-N
Literature Reference Author S.MANKU,C.LAPLANTE,D.KOPAC,T.CHAN,D.G.HALL
Literature Reference Citation J.ORG.CHEM.,66,874(2001)
Literature Reference DOI 10.1021/jo005647g
Molecular Weight 874.806 g/mol
Solvent CD3OD
Source File Reference UWVN26154