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Benzeneethanamine, 3,4-dibenzyloxy-N-benzylformyl-
SpectraBase Compound ID 82K7O92spYh
InChI InChI=1S/C30H29NO3/c32-30(21-24-10-4-1-5-11-24)31-19-18-25-16-17-28(33-22-26-12-6-2-7-13-26)29(20-25)34-23-27-14-8-3-9-15-27/h1-17,20H,18-19,21-23H2,(H,31,32)
InChIKey PEQZTVFDZANVBP-UHFFFAOYSA-N
Mol Weight 451.57 g/mol
Molecular Formula C30H29NO3
Exact Mass 451.214744 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DCPzIYapCea
Name Benzeneethanamine, 3,4-dibenzyloxy-N-benzylformyl-
Comments Computed using HOSE algorithm
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Exact Mass 451.214743795 u
Formula C30H29NO3
InChI InChI=1S/C30H29NO3/c32-30(21-24-10-4-1-5-11-24)31-19-18-25-16-17-28(33-22-26-12-6-2-7-13-26)29(20-25)34-23-27-14-8-3-9-15-27/h1-17,20H,18-19,21-23H2,(H,31,32)
InChIKey PEQZTVFDZANVBP-UHFFFAOYSA-N
Molecular Weight 451.566 g/mol
SMILES C(OC1=C(OCC2=CC=CC=C2)C=CC(=C1)CCNC(=O)CC1=CC=CC=C1)C1=CC=CC=C1