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5-[3,4-Methylenedioxybenzyl]hydantoin

View entire compound with spectra: 1 NMR, and 1 FTIR

5-[3,4-Methylenedioxybenzyl]hydantoin
SpectraBase Compound ID GtcrfOT9Z40
InChI InChI=1S/C11H10N2O4/c14-10-7(12-11(15)13-10)3-6-1-2-8-9(4-6)17-5-16-8/h1-2,4,7H,3,5H2,(H2,12,13,14,15)
InChIKey WSZBBVMTNYGMIL-UHFFFAOYSA-N
Mol Weight 234.21 g/mol
Molecular Formula C11H10N2O4
Exact Mass 234.064057 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CvaLRv6vL3Z
Name 5-[3,4-Methylenedioxybenzyl]hydantoin
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 234.064056806 u
Formula C11H10N2O4
InChI InChI=1S/C11H10N2O4/c14-10-7(12-11(15)13-10)3-6-1-2-8-9(4-6)17-5-16-8/h1-2,4,7H,3,5H2,(H2,12,13,14,15)
InChIKey WSZBBVMTNYGMIL-UHFFFAOYSA-N
Molecular Weight 234.211 g/mol
SMILES C1(=O)NC(=O)C(N1)CC1=CC=C2OCOC2=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.846607