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8-Hydroxy-4-acetyl-1H-[2]-benzopyran-1-one

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

8-Hydroxy-4-acetyl-1H-[2]-benzopyran-1-one
SpectraBase Compound ID KxZkkLUFWq9
InChI InChI=1S/C11H8O4/c1-6(12)8-5-15-11(14)10-7(8)3-2-4-9(10)13/h2-5,13H,1H3
InChIKey QQXXWUVTRCHQRG-UHFFFAOYSA-N
Mol Weight 204.18 g/mol
Molecular Formula C11H8O4
Exact Mass 204.042259 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HxIJRW4ygGA
Name 8-Hydroxy-4-acetyl-1H-[2]-benzopyran-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 204.042258734 u
Formula C11H8O4
InChI InChI=1S/C11H8O4/c1-6(12)8-5-15-11(14)10-7(8)3-2-4-9(10)13/h2-5,13H,1H3
InChIKey QQXXWUVTRCHQRG-UHFFFAOYSA-N
Molecular Weight 204.181 g/mol
SMILES C=1(C=2C(=C(O)C=CC2)C(OC1)=O)C(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.977479