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7-Methoxy-N-(4-methoxyphenyl)-2H-1,3-benzodioxole-5-carboxamide
SpectraBase Compound ID KLOXBalSCUQ
InChI InChI=1S/C16H15NO5/c1-19-12-5-3-11(4-6-12)17-16(18)10-7-13(20-2)15-14(8-10)21-9-22-15/h3-8H,9H2,1-2H3,(H,17,18)
InChIKey DBXWPHGLMYFAII-UHFFFAOYSA-N
Mol Weight 301.3 g/mol
Molecular Formula C16H15NO5
Exact Mass 301.095023 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5eMO8jFfdws
Name 7-Methoxy-N-(4-methoxyphenyl)-2H-1,3-benzodioxole-5-carboxamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 301.095022582 u
Formula C16H15NO5
InChI InChI=1S/C16H15NO5/c1-19-12-5-3-11(4-6-12)17-16(18)10-7-13(20-2)15-14(8-10)21-9-22-15/h3-8H,9H2,1-2H3,(H,17,18)
InChIKey DBXWPHGLMYFAII-UHFFFAOYSA-N
Molecular Weight 301.298 g/mol
SMILES C1=CC(=CC=C1OC)NC(=O)C1=CC(=C2C(=C1)OCO2)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.932929