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2-oxo-5-Acetylamino-4,6-diphenyl-1,2,3,4-tetrahydropyrimidine
SpectraBase Compound ID JB7OhWg17mi
InChI InChI=1S/C18H17N3O2/c1-12(22)19-17-15(13-8-4-2-5-9-13)20-18(23)21-16(17)14-10-6-3-7-11-14/h2-11,15H,1H3,(H,19,22)(H2,20,21,23)
InChIKey FMOZPZSJDAABTH-UHFFFAOYSA-N
Mol Weight 307.35 g/mol
Molecular Formula C18H17N3O2
Exact Mass 307.132077 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EF8LcrcqS6S
Name 2-oxo-5-Acetylamino-4,6-diphenyl-1,2,3,4-tetrahydropyrimidine
Comments Computed using SmartSpectra Model v1.42
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Exact Mass 307.132076797 u
Formula C18H17N3O2
InChI InChI=1S/C18H17N3O2/c1-12(22)19-17-15(13-8-4-2-5-9-13)20-18(23)21-16(17)14-10-6-3-7-11-14/h2-11,15H,1H3,(H,19,22)(H2,20,21,23)
InChIKey FMOZPZSJDAABTH-UHFFFAOYSA-N
Molecular Weight 307.353 g/mol
SMILES C1=C(C=CC=C1)C1=C(NC(C)=O)C(NC(N1)=O)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.919779