5-(4-Pyridylmethylidene)hexahydropyrimidine-2,4,6-trione

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Systematic / IUPAC Name: 5-(4-Pyridinylmethylene)-2,4,6(1H,3H,5H)-pyrimidinetrione

ID: Reference5032

Other Names: 5-(4-Pyridylmethylene)-1,3-dihydropyrimidine-2,4,6-trione;
5-(Pyridin-4-ylmethylidene)-1,3-diazinane-2,4,6-trione;
5-(Pyridin-4-ylmethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione;
Barbituric acid, 5-(4-pyridylmethylene)-

Formula: C10H7N3O3

Spectral Data

5-(4-Pyridylmethylidene)hexahydropyrimidine-2,4,6-trione mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 169
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 6/22/2016 1:31:39 PM
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Identificators

InChI InChI=1S/C10H7N3O3/c14-8-7(9(15)13-10(16)12-8)5-6-1-3-11-4-2-6/h1-5H,(H2,12,13,14,15,16)
InChI Key HUPODFHCNLKIGW-UHFFFAOYSA-N
Canonical SMILES C1=CN=CC=C1C=C2C(=O)NC(=O)NC2=O
CAS
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Other Names 5-(4-Pyridylmethylene)-1,3-dihydropyrimidine-2,4,6-trione;
5-(Pyridin-4-ylmethylidene)-1,3-diazinane-2,4,6-trione;
5-(Pyridin-4-ylmethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione;
Barbituric acid, 5-(4-pyridylmethylene)-

In Other Databases

PubChem 261533
ChemSpider 229614