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Ethyl 4'-methoxy-3'-pivalamidobiphenyl-4-carboxylate

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

Ethyl 4'-methoxy-3'-pivalamidobiphenyl-4-carboxylate
SpectraBase Compound ID 5G08jfMVsqp
InChI InChI=1S/C21H25NO4/c1-6-26-19(23)15-9-7-14(8-10-15)16-11-12-18(25-5)17(13-16)22-20(24)21(2,3)4/h7-13H,6H2,1-5H3,(H,22,24)
InChIKey KUWNIVYSPRAEIR-UHFFFAOYSA-N
Mol Weight 355.43 g/mol
Molecular Formula C21H25NO4
Exact Mass 355.178358 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID esh2HV68rd
Name Ethyl 4'-methoxy-3'-pivalamidobiphenyl-4-carboxylate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 355.178358285 u
Formula C21H25NO4
InChI InChI=1S/C21H25NO4/c1-6-26-19(23)15-9-7-14(8-10-15)16-11-12-18(25-5)17(13-16)22-20(24)21(2,3)4/h7-13H,6H2,1-5H3,(H,22,24)
InChIKey KUWNIVYSPRAEIR-UHFFFAOYSA-N
Molecular Weight 355.434 g/mol
SMILES C(NC=1C=C(C2=CC=C(C(=O)OCC)C=C2)C=CC1OC)(C(C)(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.938355