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6-Phenylamino-1H-pyrimidine-2,4-dione
SpectraBase Compound ID AfWVAaAcNnv
InChI InChI=1S/C10H9N3O2/c14-9-6-8(12-10(15)13-9)11-7-4-2-1-3-5-7/h1-6H,(H3,11,12,13,14,15)
InChIKey XKWQUTFERHHKNT-UHFFFAOYSA-N
Mol Weight 203.2 g/mol
Molecular Formula C10H9N3O2
Exact Mass 203.069477 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EUP1B3DAxTB
Name 6-Phenylamino-1H-pyrimidine-2,4-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 203.069476540 u
Formula C10H9N3O2
InChI InChI=1S/C10H9N3O2/c14-9-6-8(12-10(15)13-9)11-7-4-2-1-3-5-7/h1-6H,(H3,11,12,13,14,15)
InChIKey XKWQUTFERHHKNT-UHFFFAOYSA-N
Molecular Weight 203.201 g/mol
SMILES C1(NC(C=C(N1)NC1=CC=CC=C1)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.949961