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(4Z)-2-(4-tert-butylphenyl)-4-{3-ethoxy-4-[(4-fluorobenzyl)oxy]benzylidene}-1,3-oxazol-5(4H)-one
SpectraBase Compound ID 3RppjboFv91
InChI InChI=1S/C29H28FNO4/c1-5-33-26-17-20(8-15-25(26)34-18-19-6-13-23(30)14-7-19)16-24-28(32)35-27(31-24)21-9-11-22(12-10-21)29(2,3)4/h6-17H,5,18H2,1-4H3/b24-16-
InChIKey ITPLCRZGGMJXPI-JLPGSUDCSA-N
Mol Weight 473.54 g/mol
Molecular Formula C29H28FNO4
Exact Mass 473.200237 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FDdYEnbWWQs
Name (4Z)-2-(4-Tert-butylphenyl)-4-{3-ethoxy-4-[(4-fluorobenzyl)oxy]benzylidene}-1,3-oxazol-5(4H)-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 473.200236545 u
Formula C29H28FNO4
InChI InChI=1S/C29H28FNO4/c1-5-33-26-17-20(8-15-25(26)34-18-19-6-13-23(30)14-7-19)16-24-28(32)35-27(31-24)21-9-11-22(12-10-21)29(2,3)4/h6-17H,5,18H2,1-4H3/b24-16-
InChIKey ITPLCRZGGMJXPI-JLPGSUDCSA-N
Molecular Weight 473.544 g/mol
SMILES CCOC=1C=C(\C=C\2N=C(OC2=O)C=2C=CC(C(C)(C)C)=CC2)C=CC1OCC1=CC=C(F)C=C1