John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=Ha4aONQ9fnq SpectraBase Spectrum ID=FmMqjukQ3n2

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METHOXY-TRI-(ETHYLENEGLYCOL)-[N,N',N,N,N,N-HEXAPROPYL-HEXA-(AMINOETHYL)-AMINO]-MALONAMIDEESTER;ME3N6C3
SpectraBase Compound ID Ha4aONQ9fnq
InChI InChI=1S/C38H80N6O6/c1-8-15-40(16-9-2)22-24-42(18-11-4)26-28-44(20-13-6)29-27-43(19-12-5)25-23-41(17-10-3)21-14-39-37(45)36-38(46)50-35-34-49-33-32-48-31-30-47-7/h8-36H2,1-7H3,(H,39,45)
InChIKey RORUHVGSZHABPT-UHFFFAOYSA-N
Mol Weight 717.1 g/mol
Molecular Formula C38H80N6O6
Exact Mass 716.613935 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FmMqjukQ3n2
Name METHOXY-TRI-(ETHYLENEGLYCOL)-[N,N',N,N,N,N-HEXAPROPYL-HEXA-(AMINOETHYL)-AMINO]-MALONAMIDEESTER;ME3N6C3
Compound Number 8
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H80N6O6
InChI InChI=1S/C38H80N6O6/c1-8-15-40(16-9-2)22-24-42(18-11-4)26-28-44(20-13-6)29-27-43(19-12-5)25-23-41(17-10-3)21-14-39-37(45)36-38(46)50-35-34-49-33-32-48-31-30-47-7/h8-36H2,1-7H3,(H,39,45)
InChIKey RORUHVGSZHABPT-UHFFFAOYSA-N
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 717.090 g/mol
Sample ID 1108
Solvent CDCl3
SpectraBase Batch ID JyrjBWoAbSU