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2-(1-Cyano-1-ethoxycarbonylmethylidene)-6-phenyl-1,3-dihydropyrimidin-4(1H)-one
SpectraBase Compound ID 5XddgpqLj4W
InChI InChI=1S/C15H13N3O3/c1-2-21-15(20)11(9-16)14-17-12(8-13(19)18-14)10-6-4-3-5-7-10/h3-8,17H,2H2,1H3,(H,18,19)
InChIKey SRGBQHFMIZYWDM-UHFFFAOYSA-N
Mol Weight 283.29 g/mol
Molecular Formula C15H13N3O3
Exact Mass 283.095691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FHki82Y5kre
Name 2-(1-Cyano-1-ethoxycarbonylmethylidene)-6-phenyl-1,3-dihydropyrimidin-4(1H)-one
Appearance White needles
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13N3O3
InChI InChI=1S/C15H13N3O3/c1-2-21-15(20)11(9-16)14-17-12(8-13(19)18-14)10-6-4-3-5-7-10/h3-8,17H,2H2,1H3,(H,18,19)
InChIKey SRGBQHFMIZYWDM-UHFFFAOYSA-N
Instrument Name MX-1321
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2525
Molecular Weight 283.287 g/mol
SMILES N1C(NC(=CC1=O)c1ccccc1)=C(C#N)C(OCC)=O
SPLASH splash10-01t0-1590000000-2efd089342d780533672
Source of Spectrum Y-53-2033-2e
Wiley ID 1876748