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3'-Acetyl-2-(2,4,5-trichlorophenoxy)acetanilide

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

3'-Acetyl-2-(2,4,5-trichlorophenoxy)acetanilide
SpectraBase Compound ID 5Thjyrtcttn
InChI InChI=1S/C16H12Cl3NO3/c1-9(21)10-3-2-4-11(5-10)20-16(22)8-23-15-7-13(18)12(17)6-14(15)19/h2-7H,8H2,1H3,(H,20,22)
InChIKey SWHCRDWCTCVERA-UHFFFAOYSA-N
Mol Weight 372.64 g/mol
Molecular Formula C16H12Cl3NO3
Exact Mass 370.988276 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID BwOcBBcXkcA
Name 3'-Acetyl-2-(2,4,5-trichlorophenoxy)acetanilide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 370.988276347 u
Formula C16H12Cl3NO3
InChI InChI=1S/C16H12Cl3NO3/c1-9(21)10-3-2-4-11(5-10)20-16(22)8-23-15-7-13(18)12(17)6-14(15)19/h2-7H,8H2,1H3,(H,20,22)
InChIKey SWHCRDWCTCVERA-UHFFFAOYSA-N
Molecular Weight 372.635 g/mol
SMILES N(C1=CC=CC(=C1)C(C)=O)C(COC=1C(=CC(=C(C1)Cl)Cl)Cl)=O
Spectrum/Structure Validation Score (Raman) 0.938621