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(S)-N-Benzyl-N-(4-methyl-3-pentenyl)alaninal benzylimine

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(S)-N-Benzyl-N-(4-methyl-3-pentenyl)alaninal benzylimine
SpectraBase Compound ID K89xEHkrdBL
InChI InChI=1S/C23H30N2/c1-20(2)11-10-16-25(19-23-14-8-5-9-15-23)21(3)17-24-18-22-12-6-4-7-13-22/h4-9,11-15,17,21H,10,16,18-19H2,1-3H3/b24-17+/t21-/m0/s1
InChIKey JOCVCJDFUIJPAV-MQMHFVAESA-N
Mol Weight 334.51 g/mol
Molecular Formula C23H30N2
Exact Mass 334.240899 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JZ6arTeCf4F
Name (S)-N-Benzyl-N-(4-methyl-3-pentenyl)alaninal benzylimine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 334.240898974 u
Formula C23H30N2
InChI InChI=1S/C23H30N2/c1-20(2)11-10-16-25(19-23-14-8-5-9-15-23)21(3)17-24-18-22-12-6-4-7-13-22/h4-9,11-15,17,21H,10,16,18-19H2,1-3H3/b24-17+/t21-/m0/s1
InChIKey JOCVCJDFUIJPAV-MQMHFVAESA-N
Molecular Weight 334.507 g/mol
SMILES C(N([C@](\C=N\CC1=CC=CC=C1)(C)[H])CCC=C(C)C)C1=CC=CC=C1