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4-[(2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]benzoic acid
SpectraBase Compound ID 57LAXs3ulZK
InChI InChI=1S/C12H8N2O5/c15-9-8(10(16)14-12(19)13-9)5-6-1-3-7(4-2-6)11(17)18/h1-5H,(H,17,18)(H2,13,14,15,16,19)
InChIKey YKIMXQQTUMBLKS-UHFFFAOYSA-N
Mol Weight 260.2 g/mol
Molecular Formula C12H8N2O5
Exact Mass 260.043321 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1GsPFMHUiWo
Name 5-(4-CARBOXYBENZYLIDENE)BARBITURIC ACID
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H8N2O5
InChI InChI=1S/C12H8N2O5/c15-9-8(10(16)14-12(19)13-9)5-6-1-3-7(4-2-6)11(17)18/h1-5H,(H,17,18)(H2,13,14,15,16,19)
InChIKey YKIMXQQTUMBLKS-UHFFFAOYSA-N
Instrument Name AUTOSPEC
Molecular Weight 260.0431
SMILES OC(c1ccc(C=C2C(=O)NC(=O)NC2=O)cc1)=O
SPLASH splash10-014i-8970000000-bd9ae52f4bcbf164dfc1
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany