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(2S)-2-[4-methylpent-3-enyl-(phenylmethyl)amino]-3-phenylpropanoic acid methyl ester

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(2S)-2-[4-methylpent-3-enyl-(phenylmethyl)amino]-3-phenylpropanoic acid methyl ester
SpectraBase Compound ID 8JkSvdSOMQd
InChI InChI=1S/C23H29NO2/c1-19(2)11-10-16-24(18-21-14-8-5-9-15-21)22(23(25)26-3)17-20-12-6-4-7-13-20/h4-9,11-15,22H,10,16-18H2,1-3H3/t22-/m0/s1
InChIKey ZJDMIUGOZPPMSF-QFIPXVFZSA-N
Mol Weight 351.49 g/mol
Molecular Formula C23H29NO2
Exact Mass 351.219829 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FVVa4HcDhYY
Name (2S)-2-[4-Methylpent-3-enyl-(phenylmethyl)amino]-3-phenylpropanoic acid methyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 351.219829176 u
Formula C23H29NO2
InChI InChI=1S/C23H29NO2/c1-19(2)11-10-16-24(18-21-14-8-5-9-15-21)22(23(25)26-3)17-20-12-6-4-7-13-20/h4-9,11-15,22H,10,16-18H2,1-3H3/t22-/m0/s1
InChIKey ZJDMIUGOZPPMSF-QFIPXVFZSA-N
Molecular Weight 351.490 g/mol
SMILES [C@](N(CC=1C=CC=CC1)CCC=C(C)C)(C(=O)OC)(CC1=CC=CC=C1)[H]