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(Z,4S)-4-ethyl-5-methyl-1-phenyl-3-[[(1R)-1-phenylethyl]amino]-2-hexen-1-one

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(Z,4S)-4-ethyl-5-methyl-1-phenyl-3-[[(1R)-1-phenylethyl]amino]-2-hexen-1-one
SpectraBase Compound ID Ja5saZbGJmX
InChI InChI=1S/C23H29NO/c1-5-21(17(2)3)22(16-23(25)20-14-10-7-11-15-20)24-18(4)19-12-8-6-9-13-19/h6-18,21,24H,5H2,1-4H3/b22-16-/t18-,21+/m1/s1
InChIKey CJWKAKQAKZOTJV-FCVXVPJPSA-N
Mol Weight 335.49 g/mol
Molecular Formula C23H29NO
Exact Mass 335.224915 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KdXK7vhA9RN
Name (Z,4S)-4-Ethyl-5-methyl-1-phenyl-3-[[(1R)-1-phenylethyl]amino]-2-hexen-1-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.224914557 u
Formula C23H29NO
InChI InChI=1S/C23H29NO/c1-5-21(17(2)3)22(16-23(25)20-14-10-7-11-15-20)24-18(4)19-12-8-6-9-13-19/h6-18,21,24H,5H2,1-4H3/b22-16-/t18-,21+/m1/s1
InChIKey CJWKAKQAKZOTJV-FCVXVPJPSA-N
Molecular Weight 335.491 g/mol
SMILES C(\C=C\(N[C@@](C1=CC=CC=C1)(C)[H])[C@](C(C)C)(CC)[H])(=O)C=1C=CC=CC1