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(2-Bromophenyl)(3,5-dichloro-2-hydroxyphenyl)methanone, trimethylacetate

View entire compound with spectra: 1 NMR

(2-Bromophenyl)(3,5-dichloro-2-hydroxyphenyl)methanone, trimethylacetate
SpectraBase Compound ID JxLjsRiHARW
InChI InChI=1S/C18H15BrCl2O3/c1-18(2,3)17(23)24-16-12(8-10(20)9-14(16)21)15(22)11-6-4-5-7-13(11)19/h4-9H,1-3H3
InChIKey ZIUJPLRTMAIHRR-UHFFFAOYSA-N
Mol Weight 430.13 g/mol
Molecular Formula C18H15BrCl2O3
Exact Mass 427.958163 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 22zrkZxXWr9
Name (2-Bromophenyl)(3,5-dichloro-2-hydroxyphenyl)methanone, trimethylacetate
Comments Computed using HOSE algorithm
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Exact Mass 427.958162740 u
Formula C18H15BrCl2O3
InChI InChI=1S/C18H15BrCl2O3/c1-18(2,3)17(23)24-16-12(8-10(20)9-14(16)21)15(22)11-6-4-5-7-13(11)19/h4-9H,1-3H3
InChIKey ZIUJPLRTMAIHRR-UHFFFAOYSA-N
Molecular Weight 430.125 g/mol
SMILES C1(Br)=C(C=CC=C1)C(=O)C1=C(C(=CC(=C1)Cl)Cl)OC(C(C)(C)C)=O