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5-Bromanyl-6-methyl-3-phenyl-1H-pyrimidine-2,4-dione

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5-Bromanyl-6-methyl-3-phenyl-1H-pyrimidine-2,4-dione
SpectraBase Compound ID 3LXGr6NyyGO
InChI InChI=1S/C11H9BrN2O2/c1-7-9(12)10(15)14(11(16)13-7)8-5-3-2-4-6-8/h2-6H,1H3,(H,13,16)
InChIKey QMASYZYAMUINDL-UHFFFAOYSA-N
Mol Weight 281.11 g/mol
Molecular Formula C11H9BrN2O2
Exact Mass 279.984741 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID J1cEUCdx4XO
Name 5-Bromanyl-6-methyl-3-phenyl-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 279.984740536 u
Formula C11H9BrN2O2
InChI InChI=1S/C11H9BrN2O2/c1-7-9(12)10(15)14(11(16)13-7)8-5-3-2-4-6-8/h2-6H,1H3,(H,13,16)
InChIKey QMASYZYAMUINDL-UHFFFAOYSA-N
Molecular Weight 281.109 g/mol
SMILES C1(N(C(NC(=C1Br)C)=O)C=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.958785