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(2-S)-2-(N-BENZYLAMINO)-1-PHENYL-3,5-HEPTADIENE

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(2-S)-2-(N-BENZYLAMINO)-1-PHENYL-3,5-HEPTADIENE
SpectraBase Compound ID LOuT4ALuKbO
InChI InChI=1S/2C20H23N/c2*1-2-3-6-15-20(16-18-11-7-4-8-12-18)21-17-19-13-9-5-10-14-19/h2*2-15,20-21H,16-17H2,1H3/b3-2+,15-6+;3-2-,15-6+/t2*20-/m11/s1
InChIKey HYJOZJIZUVYEGM-ZCWUTBRMSA-N
Mol Weight 554.82 g/mol
Molecular Formula C40H46N2
Exact Mass 554.366099 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J7TD3NFXMIv
Name (2-S)-2-(N-BENZYLAMINO)-1-PHENYL-3,5-HEPTADIENE
Compound Number MIXTU RE_OF_#(3-E,5-E)-13C_AND_(3-E,5-Z) -13C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H46N2
InChI InChI=1S/2C20H23N/c2*1-2-3-6-15-20(16-18-11-7-4-8-12-18)21-17-19-13-9-5-10-14-19/h2*2-15,20-21H,16-17H2,1H3/b3-2+,15-6+;3-2-,15-6+/t2*20-/m11/s1
InChIKey HYJOZJIZUVYEGM-ZCWUTBRMSA-N
Literature Reference Author H.TAKEUCHI,T.FUJIMOTO,K.HOSHINO,J.MOTOYOSHIYA,A.KAKEHI,I.YAM AMOTO
Literature Reference Citation J.ORG.CHEM.,63,7172(1998)
Literature Reference DOI 10.1021/jo980181b
Molecular Weight 554.819 g/mol
Sample ID 26004
Solvent CDCl3