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5-Methyl-5-phenylhydantoin acetate

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

5-Methyl-5-phenylhydantoin acetate
SpectraBase Compound ID LX962WZAUoU
InChI InChI=1S/C12H12N2O3/c1-8(15)14-10(16)12(2,13-11(14)17)9-6-4-3-5-7-9/h3-7H,1-2H3,(H,13,17)
InChIKey UILKMMLAUABSNS-UHFFFAOYSA-N
Mol Weight 232.24 g/mol
Molecular Formula C12H12N2O3
Exact Mass 232.084792 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID E8FOXRtBK6
Name 5-Methyl-5-phenylhydantoin acetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 232.084792251 u
Formula C12H12N2O3
InChI InChI=1S/C12H12N2O3/c1-8(15)14-10(16)12(2,13-11(14)17)9-6-4-3-5-7-9/h3-7H,1-2H3,(H,13,17)
InChIKey UILKMMLAUABSNS-UHFFFAOYSA-N
Molecular Weight 232.239 g/mol
SMILES C1=C(C=CC=C1)C1(C(N(C(=O)C)C(N1)=O)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.956908