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4-[o-Chlorophenyl]-2H-1,3-[3H]-oxazine-2,6-dione
SpectraBase Compound ID ItNAqj8nSkN
InChI InChI=1S/C10H6ClNO3/c11-7-4-2-1-3-6(7)8-5-9(13)15-10(14)12-8/h1-5H,(H,12,14)
InChIKey SKJOPTOBUFXKMV-UHFFFAOYSA-N
Mol Weight 223.61 g/mol
Molecular Formula C10H6ClNO3
Exact Mass 223.003621 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HIPzqkpmoFX
Name 4-[o-Chlorophenyl]-2H-1,3-[3H]-oxazine-2,6-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 223.003620754 u
Formula C10H6ClNO3
InChI InChI=1S/C10H6ClNO3/c11-7-4-2-1-3-6(7)8-5-9(13)15-10(14)12-8/h1-5H,(H,12,14)
InChIKey SKJOPTOBUFXKMV-UHFFFAOYSA-N
Molecular Weight 223.615 g/mol
SMILES C1=CC=CC(=C1Cl)C=1NC(OC(C1)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.966947