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Benzamide, N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-2,4,5-trimethoxy-
SpectraBase Compound ID AYEm8n2pfQm
InChI InChI=1S/C23H21NO7/c1-26-19-12-21(28-3)20(27-2)11-17(19)23(25)24-14-4-6-15(7-5-14)31-16-8-9-18-22(10-16)30-13-29-18/h4-12H,13H2,1-3H3,(H,24,25)
InChIKey CPMSUTBZQPMASR-UHFFFAOYSA-N
Mol Weight 423.42 g/mol
Molecular Formula C23H21NO7
Exact Mass 423.131802 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2Jj8RZjpERJ
Name Benzamide, N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-2,4,5-trimethoxy-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 423.131802013 u
Formula C23H21NO7
InChI InChI=1S/C23H21NO7/c1-26-19-12-21(28-3)20(27-2)11-17(19)23(25)24-14-4-6-15(7-5-14)31-16-8-9-18-22(10-16)30-13-29-18/h4-12H,13H2,1-3H3,(H,24,25)
InChIKey CPMSUTBZQPMASR-UHFFFAOYSA-N
Molecular Weight 423.421 g/mol
SMILES C(C1=C(OC)C=C(OC)C(OC)=C1)(=O)NC=1C=CC(OC2=CC=C3C(=C2)OCO3)=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.852185