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5-Ethyl-5-p-tolylbarbituric acid

View entire compound with spectra: 3 NMR, 3 FTIR, 1 Raman, 1 UV-Vis, and 5 MS (GC)

5-Ethyl-5-p-tolylbarbituric acid
SpectraBase Compound ID GwohqXhA5mK
InChI InChI=1S/C13H14N2O3/c1-3-13(9-6-4-8(2)5-7-9)10(16)14-12(18)15-11(13)17/h4-7H,3H2,1-2H3,(H2,14,15,16,17,18)
InChIKey ZYJDWGKPBQDCBX-UHFFFAOYSA-N
Mol Weight 246.27 g/mol
Molecular Formula C13H14N2O3
Exact Mass 246.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FrsQan2X5w1
Name Ethyltolylbarbituric acid
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved.
Formula C14H18N2O3
InChI InChI=1S/C13H14N2O3/c1-3-13(9-6-4-8(2)5-7-9)10(16)14-12(18)15-11(13)17/h4-7H,3H2,1-2H3,(H2,14,15,16,17,18)
InChIKey ZYJDWGKPBQDCBX-UHFFFAOYSA-N
SMILES N1C(C(C(NC1=O)=O)(c1ccc(cc1)C)CC)=O
SPLASH splash10-014i-5980000000-0c423cd775253ddc2daf
Source of Spectrum Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences