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2,4(1H,3H)-pyrimidinedione, 6-methyl-1-(phenylmethyl)-

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

2,4(1H,3H)-pyrimidinedione, 6-methyl-1-(phenylmethyl)-
SpectraBase Compound ID FsjLtRUzSyp
InChI InChI=1S/C12H12N2O2/c1-9-7-11(15)13-12(16)14(9)8-10-5-3-2-4-6-10/h2-7H,8H2,1H3,(H,13,15,16)
InChIKey LXRVJHIISSYWEJ-UHFFFAOYSA-N
Mol Weight 216.24 g/mol
Molecular Formula C12H12N2O2
Exact Mass 216.089878 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3HZjuazolow
Name 2,4(1H,3H)-Pyrimidinedione, 6-methyl-1-(phenylmethyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 216.089877632 u
Formula C12H12N2O2
InChI InChI=1S/C12H12N2O2/c1-9-7-11(15)13-12(16)14(9)8-10-5-3-2-4-6-10/h2-7H,8H2,1H3,(H,13,15,16)
InChIKey LXRVJHIISSYWEJ-UHFFFAOYSA-N
Molecular Weight 216.240 g/mol
SMILES CC1=CC(=O)NC(N1CC1=CC=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.979358