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(2S,E)-N,N-Dibenzyl-5-methyl-1-phenylhex-3-en-2-amine

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(2S,E)-N,N-Dibenzyl-5-methyl-1-phenylhex-3-en-2-amine
SpectraBase Compound ID BbDJd5sc8dt
InChI InChI=1S/C27H31N/c1-23(2)18-19-27(20-24-12-6-3-7-13-24)28(21-25-14-8-4-9-15-25)22-26-16-10-5-11-17-26/h3-19,23,27H,20-22H2,1-2H3/b19-18+/t27-/m1/s1
InChIKey BTPHGVZCSJXNLI-SRUCCPAXSA-N
Mol Weight 369.55 g/mol
Molecular Formula C27H31N
Exact Mass 369.24565 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LtkOonJ8EOB
Name (2S,E)-N,N-Dibenzyl-5-methyl-1-phenylhex-3-en-2-amine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 369.245650002 u
Formula C27H31N
InChI InChI=1S/C27H31N/c1-23(2)18-19-27(20-24-12-6-3-7-13-24)28(21-25-14-8-4-9-15-25)22-26-16-10-5-11-17-26/h3-19,23,27H,20-22H2,1-2H3/b19-18+/t27-/m1/s1
InChIKey BTPHGVZCSJXNLI-SRUCCPAXSA-N
Molecular Weight 369.552 g/mol
SMILES C1(=CC=CC=C1)C[C@@](\C=C\C(C)C)(N(CC1=CC=CC=C1)CC=1C=CC=CC1)[H]