John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=15QuzitPsbQ SpectraBase Spectrum ID=FoMANzqEWrz

(accessed ).
METHOXY-ETHYLENEGLYCOL-[N,N',N,N,N,N-HEXAPROPYL-HEXA-(AMINOETHYL)-AMINO]-MALONAMIDEESTER-QUATERNARY-METHYL-AMMONIUM-SALT;ME3N6(+)C3
SpectraBase Compound ID 15QuzitPsbQ
InChI InChI=1S/C43H94N6O6.5HI/c1-13-20-45(7,21-14-2)27-29-47(9,23-16-4)31-33-49(11,25-18-6)34-32-48(10,24-17-5)30-28-46(8,22-15-3)26-19-44-42(50)41-43(51)55-40-39-54-38-37-53-36-35-52-12;;;;;/h13-41H2,1-12H3;5*1H/q+4;;;;;/p-4
InChIKey SZZNJWAPVZBZNH-UHFFFAOYSA-J
Mol Weight 1426.79136 g/mol
Molecular Formula C43H95I5N6O6
Exact Mass 1426.253695 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 FoMANzqEWrz
Name METHOXY-ETHYLENEGLYCOL-[N,N',N,N,N,N-HEXAPROPYL-HEXA-(AMINOETHYL)-AMINO]-MALONAMIDEESTER-QUATERNARY-METHYL-AMMONIUM-SALT;ME3N6(+)C3
Compound Number 10
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C43H95I5N6O6
InChI InChI=1S/C43H94N6O6.5HI/c1-13-20-45(7,21-14-2)27-29-47(9,23-16-4)31-33-49(11,25-18-6)34-32-48(10,24-17-5)30-28-46(8,22-15-3)26-19-44-42(50)41-43(51)55-40-39-54-38-37-53-36-35-52-12;;;;;/h13-41H2,1-12H3;5*1H/q+4;;;;;/p-4
InChIKey SZZNJWAPVZBZNH-UHFFFAOYSA-J
Literature Reference Author S.THOTA,M.WANG,S.JEON,S.MARAGANI,M.R.HAMBLIN,L.Y.CHIANG
Literature Reference Citation MOLECULES,17,5225(2012)
Literature Reference DOI 10.3390/molecules17055225
Molecular Weight 1426.786 g/mol
Sample ID 1110
Solvent DMSO-D6
SpectraBase Batch ID JoDg8pCpD6Q