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2-(3,4-Dimethoxyphenyl)-N-formyl-6,7-dimethoxynaphthalen-1-amine
SpectraBase Compound ID 98ClEyC1fZE
InChI InChI=1S/C21H21NO5/c1-24-17-8-6-13(9-18(17)25-2)15-7-5-14-10-19(26-3)20(27-4)11-16(14)21(15)22-12-23/h5-12H,1-4H3,(H,22,23)
InChIKey VNSUYIFIJLXIBU-UHFFFAOYSA-N
Mol Weight 367.4 g/mol
Molecular Formula C21H21NO5
Exact Mass 367.141973 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID F9W4RwHgETE
Name 2-(3,4-Dimethoxyphenyl)-N-formyl-6,7-dimethoxynaphthalen-1-amine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 367.141972775 u
Formula C21H21NO5
InChI InChI=1S/C21H21NO5/c1-24-17-8-6-13(9-18(17)25-2)15-7-5-14-10-19(26-3)20(27-4)11-16(14)21(15)22-12-23/h5-12H,1-4H3,(H,22,23)
InChIKey VNSUYIFIJLXIBU-UHFFFAOYSA-N
Molecular Weight 367.401 g/mol
SMILES C12=C(C(C=3C=C(OC)C(=CC3)OC)=CC=C1C=C(OC)C(=C2)OC)NC=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.921742