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Benzamide, 4-bromo-N-(3,4-methylenedioxybenzyl)-

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

Benzamide, 4-bromo-N-(3,4-methylenedioxybenzyl)-
SpectraBase Compound ID 6AmnGZFDYY9
InChI InChI=1S/C15H12BrNO3/c16-12-4-2-11(3-5-12)15(18)17-8-10-1-6-13-14(7-10)20-9-19-13/h1-7H,8-9H2,(H,17,18)
InChIKey RUOJBMYYQISPAI-UHFFFAOYSA-N
Mol Weight 334.17 g/mol
Molecular Formula C15H12BrNO3
Exact Mass 333.000056 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 47Y1akdvMmn
Name Benzamide, 4-bromo-N-(3,4-methylenedioxybenzyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 333.000056247 u
Formula C15H12BrNO3
InChI InChI=1S/C15H12BrNO3/c16-12-4-2-11(3-5-12)15(18)17-8-10-1-6-13-14(7-10)20-9-19-13/h1-7H,8-9H2,(H,17,18)
InChIKey RUOJBMYYQISPAI-UHFFFAOYSA-N
Molecular Weight 334.169 g/mol
SMILES C(NCC=1C=C2OCOC2=CC1)(C1=CC=C(C=C1)Br)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.901319