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5'-Chloro-2'-hydroxy-2,4-dimethyl-chalcone

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

5'-Chloro-2'-hydroxy-2,4-dimethyl-chalcone
SpectraBase Compound ID 7usjf9OImDR
InChI InChI=1S/C17H15ClO2/c1-11-3-4-13(12(2)9-11)5-7-16(19)15-10-14(18)6-8-17(15)20/h3-10,20H,1-2H3/b7-5+
InChIKey SZJSECXUIKKWES-FNORWQNLSA-N
Mol Weight 286.76 g/mol
Molecular Formula C17H15ClO2
Exact Mass 286.076057 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GZJeipVMk0L
Name 5'-Chloro-2'-hydroxy-2,4-dimethyl-chalcone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 286.076057421 u
Formula C17H15ClO2
InChI InChI=1S/C17H15ClO2/c1-11-3-4-13(12(2)9-11)5-7-16(19)15-10-14(18)6-8-17(15)20/h3-10,20H,1-2H3/b7-5+
InChIKey SZJSECXUIKKWES-FNORWQNLSA-N
SMILES C(=O)(\C=C\C1=C(C=C(C=C1)C)C)C1=C(O)C=CC(Cl)=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.961223