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3',5'-Dibromo-2',4'-dimethyl-6'-hydroxypropiophenone

View entire compound with spectra: 1 FTIR, and 1 Raman

3',5'-Dibromo-2',4'-dimethyl-6'-hydroxypropiophenone
SpectraBase Compound ID IbXcj5xMkA3
InChI InChI=1S/C11H12Br2O2/c1-4-7(14)8-5(2)9(12)6(3)10(13)11(8)15/h15H,4H2,1-3H3
InChIKey QSOONRRXDURJGB-UHFFFAOYSA-N
Mol Weight 336.02 g/mol
Molecular Formula C11H12Br2O2
Exact Mass 333.920406 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 4DkBlTBRTAk
Name 3',5'-Dibromo-2',4'-dimethyl-6'-hydroxypropiophenone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 333.920405624 u
Formula C11H12Br2O2
InChI InChI=1S/C11H12Br2O2/c1-4-7(14)8-5(2)9(12)6(3)10(13)11(8)15/h15H,4H2,1-3H3
InChIKey QSOONRRXDURJGB-UHFFFAOYSA-N
Molecular Weight 336.023 g/mol
SMILES OC1=C(C(C)=C(Br)C(=C1Br)C)C(=O)CC
Spectrum/Structure Validation Score (Raman) 0.88921