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2-(5-Bromo-2-hydroxyphenyl)-2,3-dihydrochromen-4-one

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

2-(5-Bromo-2-hydroxyphenyl)-2,3-dihydrochromen-4-one
SpectraBase Compound ID ElQOvsUJJJP
InChI InChI=1S/C15H11BrO3/c16-9-5-6-12(17)11(7-9)15-8-13(18)10-3-1-2-4-14(10)19-15/h1-7,15,17H,8H2
InChIKey PPGPDTHIZBLLKY-UHFFFAOYSA-N
Mol Weight 319.15 g/mol
Molecular Formula C15H11BrO3
Exact Mass 317.989157 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1JJDDrWhp5A
Name 2-(5-Bromo-2-hydroxyphenyl)-2,3-dihydrochromen-4-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 317.989157211 u
Formula C15H11BrO3
InChI InChI=1S/C15H11BrO3/c16-9-5-6-12(17)11(7-9)15-8-13(18)10-3-1-2-4-14(10)19-15/h1-7,15,17H,8H2
InChIKey PPGPDTHIZBLLKY-UHFFFAOYSA-N
Molecular Weight 319.154 g/mol
SMILES C1(CC(C=2C=CC=CC2O1)=O)C=1C(=CC=C(C1)Br)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.966356