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Coumarin-3-carboxamide, 6-methoxy-N-(2-bromophenyl)-

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

Coumarin-3-carboxamide, 6-methoxy-N-(2-bromophenyl)-
SpectraBase Compound ID LOaZOqfeziK
InChI InChI=1S/C17H12BrNO4/c1-22-11-6-7-15-10(8-11)9-12(17(21)23-15)16(20)19-14-5-3-2-4-13(14)18/h2-9H,1H3,(H,19,20)
InChIKey HOUFIQIJDMKYPA-UHFFFAOYSA-N
Mol Weight 374.19 g/mol
Molecular Formula C17H12BrNO4
Exact Mass 372.994971 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7vjZzJvf3k3
Name Coumarin-3-carboxamide, 6-methoxy-N-(2-bromophenyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 372.994970866 u
Formula C17H12BrNO4
InChI InChI=1S/C17H12BrNO4/c1-22-11-6-7-15-10(8-11)9-12(17(21)23-15)16(20)19-14-5-3-2-4-13(14)18/h2-9H,1H3,(H,19,20)
InChIKey HOUFIQIJDMKYPA-UHFFFAOYSA-N
Molecular Weight 374.190 g/mol
SMILES C=1(C(OC=2C(C1)=CC(OC)=CC2)=O)C(NC1=CC=CC=C1Br)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.977356