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N-[(3'-Benzyloxy)-4'-methoxyphenethyl]-(p-hydroxyphenyl)-propanamide
SpectraBase Compound ID EJgGwM3dACL
InChI InChI=1S/C25H27NO4/c1-29-23-13-9-20(17-24(23)30-18-21-5-3-2-4-6-21)15-16-26-25(28)14-10-19-7-11-22(27)12-8-19/h2-9,11-13,17,27H,10,14-16,18H2,1H3,(H,26,28)
InChIKey CEFZWRXOGFZIPM-UHFFFAOYSA-N
Mol Weight 405.49 g/mol
Molecular Formula C25H27NO4
Exact Mass 405.194008 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DrB7laXdQ4J
Name N-[(3'-Benzyloxy)-4'-methoxyphenethyl]-(p-hydroxyphenyl)-propanamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 405.194008349 u
Formula C25H27NO4
InChI InChI=1S/C25H27NO4/c1-29-23-13-9-20(17-24(23)30-18-21-5-3-2-4-6-21)15-16-26-25(28)14-10-19-7-11-22(27)12-8-19/h2-9,11-13,17,27H,10,14-16,18H2,1H3,(H,26,28)
InChIKey CEFZWRXOGFZIPM-UHFFFAOYSA-N
Molecular Weight 405.494 g/mol
SMILES C1(OCC2=CC=CC=C2)=C(C=CC(=C1)CCNC(=O)CCC1=CC=C(C=C1)O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.883115