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8-Bromo-2,4-dihydro-1H-3,1-benzoxazine-2,4-dione

View entire compound with spectra: 1 FTIR

8-Bromo-2,4-dihydro-1H-3,1-benzoxazine-2,4-dione
SpectraBase Compound ID 8ANiX4RoJKT
InChI InChI=1S/C8H4BrNO3/c9-5-3-1-2-4-6(5)10-8(12)13-7(4)11/h1-3H,(H,10,12)
InChIKey YRJWMRDVBYWGKK-UHFFFAOYSA-N
Mol Weight 242.03 g/mol
Molecular Formula C8H4BrNO3
Exact Mass 240.937456 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3O93ePA90UT
Name 8-Bromo-2,4-dihydro-1H-3,1-benzoxazine-2,4-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 240.937455990 u
Formula C8H4BrNO3
InChI InChI=1S/C8H4BrNO3/c9-5-3-1-2-4-6(5)10-8(12)13-7(4)11/h1-3H,(H,10,12)
InChIKey YRJWMRDVBYWGKK-UHFFFAOYSA-N
Molecular Weight 242.028 g/mol
SMILES C1(Br)=C2C(=CC=C1)C(=O)OC(N2)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.933459