Glycine, N-[3-([1,1'-biphenyl]-4-yloxy)-3-(4-fluorophenyl)propyl]-N-methyl-, methyl ester

SpectraBase Compound ID	JzY1ed5TeuW
InChI	InChI=1S/C25H26FNO3/c1-27(18-25(28)29-2)17-16-24(21-8-12-22(26)13-9-21)30-23-14-10-20(11-15-23)19-6-4-3-5-7-19/h3-15,24H,16-18H2,1-2H3
InChIKey	ZOJAWWUHKCSKRU-UHFFFAOYSA-N Google Search
Mol Weight	407.49 g/mol
Molecular Formula	C25H26FNO3
Exact Mass	407.189672 g/mol

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SpectraBase Spectrum ID	3hrEt8TUdV7
Name	Glycine, N-[3-([1,1'-biphenyl]-4-yloxy)-3-(4-fluorophenyl)propyl]-N-methyl-, methyl ester
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	407.189671861 u
Formula	C25H26FNO3
InChI	InChI=1S/C25H26FNO3/c1-27(18-25(28)29-2)17-16-24(21-8-12-22(26)13-9-21)30-23-14-10-20(11-15-23)19-6-4-3-5-7-19/h3-15,24H,16-18H2,1-2H3
InChIKey	ZOJAWWUHKCSKRU-UHFFFAOYSA-N
Molecular Weight	407.485 g/mol
SMILES	C1(F)=CC=C(C=C1)C(OC1=CC=C(C=C1)C1=CC=CC=C1)CCN(CC(=O)OC)C
Spectrum/Structure Validation Score (Vapor Phase IR)	0.806178