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(E)-5-(4-morpholinyl)-3,5-diphenyl-4-pentenoic acid tert-butyl ester

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(E)-5-(4-morpholinyl)-3,5-diphenyl-4-pentenoic acid tert-butyl ester
SpectraBase Compound ID KT4i0fGRWfw
InChI InChI=1S/C25H31NO3/c1-25(2,3)29-24(27)19-22(20-10-6-4-7-11-20)18-23(21-12-8-5-9-13-21)26-14-16-28-17-15-26/h4-13,18,22H,14-17,19H2,1-3H3/b23-18+
InChIKey GDXTVLMDIWAZEZ-PTGBLXJZSA-N
Mol Weight 393.53 g/mol
Molecular Formula C25H31NO3
Exact Mass 393.230394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Yakv4OWbGG
Name (E)-5-(4-Morpholinyl)-3,5-diphenyl-4-pentenoic acid tert-butyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 393.230393859 u
Formula C25H31NO3
InChI InChI=1S/C25H31NO3/c1-25(2,3)29-24(27)19-22(20-10-6-4-7-11-20)18-23(21-12-8-5-9-13-21)26-14-16-28-17-15-26/h4-13,18,22H,14-17,19H2,1-3H3/b23-18+
InChIKey GDXTVLMDIWAZEZ-PTGBLXJZSA-N
Molecular Weight 393.527 g/mol
SMILES C(CC(\C=C/(C=1C=CC=CC1)N1CCOCC1)C=1C=CC=CC1)(=O)OC(C)(C)C