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3-{[N-(.alpha.-<4'-Chlorophenyl>benzyl)]-N-benzyl]amino}-1-propanol
SpectraBase Compound ID HumxDX6BrYa
InChI InChI=1S/C24H26ClNO/c25-23-14-12-22(13-15-23)24(18-20-8-3-1-4-9-20)26(16-7-17-27)19-21-10-5-2-6-11-21/h1-6,8-15,24,27H,7,16-19H2
InChIKey KUOPNXRETXBZFW-UHFFFAOYSA-N
Mol Weight 379.93 g/mol
Molecular Formula C24H26ClNO
Exact Mass 379.170292 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3xabBhaeQxv
Name 3-{[N-(.alpha.-<4'-Chlorophenyl>benzyl)]-N-benzyl]amino}-1-propanol
Comments Computed using HOSE algorithm
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Exact Mass 379.170292160 u
Formula C24H26ClNO
InChI InChI=1S/C24H26ClNO/c25-23-14-12-22(13-15-23)24(18-20-8-3-1-4-9-20)26(16-7-17-27)19-21-10-5-2-6-11-21/h1-6,8-15,24,27H,7,16-19H2
InChIKey KUOPNXRETXBZFW-UHFFFAOYSA-N
Molecular Weight 379.931 g/mol
SMILES C(N(CC1=CC=CC=C1)CCCO)(C1=CC=C(C=C1)Cl)CC=1C=CC=CC1