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6-bromo-N-(3,4-dimethoxyphenethyl)-m-anisamide

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

6-bromo-N-(3,4-dimethoxyphenethyl)-m-anisamide
SpectraBase Compound ID ANBNyxtYGTK
InChI InChI=1S/C18H20BrNO4/c1-22-13-5-6-15(19)14(11-13)18(21)20-9-8-12-4-7-16(23-2)17(10-12)24-3/h4-7,10-11H,8-9H2,1-3H3,(H,20,21)
InChIKey DMEVRRMGBQGREU-UHFFFAOYSA-N
Mol Weight 394.27 g/mol
Molecular Formula C18H20BrNO4
Exact Mass 393.057571 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID ES30lqE1onS
Name 6-Bromo-N-(3,4-dimethoxyphenethyl)-m-anisamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 393.057571124 u
Formula C18H20BrNO4
InChI InChI=1S/C18H20BrNO4/c1-22-13-5-6-15(19)14(11-13)18(21)20-9-8-12-4-7-16(23-2)17(10-12)24-3/h4-7,10-11H,8-9H2,1-3H3,(H,20,21)
InChIKey DMEVRRMGBQGREU-UHFFFAOYSA-N
Molecular Weight 394.265 g/mol
SMILES N(C(C1=CC(=CC=C1Br)OC)=O)CCC=1C=C(C(=CC1)OC)OC
Spectrum/Structure Validation Score (Raman) 0.895127