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(1R,2R,4E)-1-phenyl-1-N,2-N-bis[(1S)-1-phenylethyl]hepta-4,6-diene-1,2-diamine

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(1R,2R,4E)-1-phenyl-1-N,2-N-bis[(1S)-1-phenylethyl]hepta-4,6-diene-1,2-diamine
SpectraBase Compound ID 1AQ0oNmBjsq
InChI InChI=1S/C29H34N2/c1-4-5-9-22-28(30-23(2)25-16-10-6-11-17-25)29(27-20-14-8-15-21-27)31-24(3)26-18-12-7-13-19-26/h4-21,23-24,28-31H,1,22H2,2-3H3/b9-5+/t23-,24-,28+,29+/m0/s1
InChIKey VAAOMFOXEDLUJM-KTCZQJHUSA-N
Mol Weight 410.6 g/mol
Molecular Formula C29H34N2
Exact Mass 410.272199 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4044231P1X9
Name (1R,2R,4E)-1-Phenyl-1-N,2-N-bis[(1S)-1-phenylethyl]hepta-4,6-diene-1,2-diamine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 410.272199103 u
Formula C29H34N2
InChI InChI=1S/C29H34N2/c1-4-5-9-22-28(30-23(2)25-16-10-6-11-17-25)29(27-20-14-8-15-21-27)31-24(3)26-18-12-7-13-19-26/h4-21,23-24,28-31H,1,22H2,2-3H3/b9-5+/t23-,24-,28+,29+/m0/s1
InChIKey VAAOMFOXEDLUJM-KTCZQJHUSA-N
Molecular Weight 410.605 g/mol
SMILES [C@@](N[C@](C1=CC=CC=C1)(C)[H])([C@](N[C@](C1=CC=CC=C1)(C)[H])(C\C=C\C=C)[H])(C=1C=CC=CC1)[H]