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Trichloroacetamide, N-(3,4-dimethoxyphenethyl)-

View entire compound with spectra: 1 NMR, and 1 FTIR

Trichloroacetamide, N-(3,4-dimethoxyphenethyl)-
SpectraBase Compound ID AVrqq3nOVE6
InChI InChI=1S/C12H14Cl3NO3/c1-18-9-4-3-8(7-10(9)19-2)5-6-16-11(17)12(13,14)15/h3-4,7H,5-6H2,1-2H3,(H,16,17)
InChIKey KNWACDYQQXCWSC-UHFFFAOYSA-N
Mol Weight 326.61 g/mol
Molecular Formula C12H14Cl3NO3
Exact Mass 325.003926 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5zSoVwfMpQY
Name Trichloroacetamide, N-(3,4-dimethoxyphenethyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 325.003926412 u
Formula C12H14Cl3NO3
InChI InChI=1S/C12H14Cl3NO3/c1-18-9-4-3-8(7-10(9)19-2)5-6-16-11(17)12(13,14)15/h3-4,7H,5-6H2,1-2H3,(H,16,17)
InChIKey KNWACDYQQXCWSC-UHFFFAOYSA-N
Molecular Weight 326.607 g/mol
SMILES C(C(Cl)(Cl)Cl)(=O)NCCC=1C=C(OC)C(OC)=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.820277