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2-Cyano-3-(4-hydroxy-3-methoxyphenyl)propanamide
SpectraBase Compound ID 1vRpcv5Fafn
InChI InChI=1S/C11H12N2O3/c1-16-10-5-7(2-3-9(10)14)4-8(6-12)11(13)15/h2-3,5,8,14H,4H2,1H3,(H2,13,15)
InChIKey SSXZUNAUAQDGKK-UHFFFAOYSA-N
Mol Weight 220.23 g/mol
Molecular Formula C11H12N2O3
Exact Mass 220.084792 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9mJHgs24Nmd
Name 2-Cyano-3-(4-hydroxy-3-methoxyphenyl)propanamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 220.084792251 u
Formula C11H12N2O3
InChI InChI=1S/C11H12N2O3/c1-16-10-5-7(2-3-9(10)14)4-8(6-12)11(13)15/h2-3,5,8,14H,4H2,1H3,(H2,13,15)
InChIKey SSXZUNAUAQDGKK-UHFFFAOYSA-N
Molecular Weight 220.228 g/mol
SMILES C1=C(C=C(C(=C1)O)OC)CC(C(N)=O)C#N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.858053