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N,N'-bis(3'-Phenylpropyl)-N-{[3-(3''-phenylpropyl)amino]propyl}propane-1,3-diamine
SpectraBase Compound ID 5Kkg4Dt41EE
InChI InChI=1S/C33H47N3/c1-4-15-31(16-5-1)21-10-24-34-26-13-29-36(28-12-23-33-19-8-3-9-20-33)30-14-27-35-25-11-22-32-17-6-2-7-18-32/h1-9,15-20,34-35H,10-14,21-30H2
InChIKey AVQQUUYWPICZIZ-UHFFFAOYSA-N
Mol Weight 485.8 g/mol
Molecular Formula C33H47N3
Exact Mass 485.376999 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KjB472THWvA
Name N,N'-bis(3'-Phenylpropyl)-N-{[3-(3''-phenylpropyl)amino]propyl}propane-1,3-diamine
Comments Computed using HOSE algorithm
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Exact Mass 485.376998525 u
Formula C33H47N3
InChI InChI=1S/C33H47N3/c1-4-15-31(16-5-1)21-10-24-34-26-13-29-36(28-12-23-33-19-8-3-9-20-33)30-14-27-35-25-11-22-32-17-6-2-7-18-32/h1-9,15-20,34-35H,10-14,21-30H2
InChIKey AVQQUUYWPICZIZ-UHFFFAOYSA-N
Molecular Weight 485.760 g/mol
SMILES C(N(CCCNCCCC=1C=CC=CC1)CCCC1=CC=CC=C1)CCNCCCC=1C=CC=CC1