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Thiocyanic acid, 3,5-dibromo-2-hydroxy-4-methylphenacyl ester
SpectraBase Compound ID 21RwdfrkZui
InChI InChI=1S/C10H7Br2NO2S/c1-5-7(11)2-6(10(15)9(5)12)8(14)3-16-4-13/h2,15H,3H2,1H3
InChIKey JIOXQYQPFVXOAJ-UHFFFAOYSA-N
Mol Weight 365.04 g/mol
Molecular Formula C10H7Br2NO2S
Exact Mass 362.856426 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DHDrjeX80Pw
Name THIOCYANIC ACID, 3,5-DIBROMO-2-HYDROXY-4-METHYLPHENACYL ESTER
Source of Sample A. Cascaval, "Al. I. CUZA" University of Iassy, Iasi, Romania
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H7Br2NO2S
InChI InChI=1S/C10H7Br2NO2S/c1-5-7(11)2-6(10(15)9(5)12)8(14)3-16-4-13/h2,15H,3H2,1H3
InChIKey JIOXQYQPFVXOAJ-UHFFFAOYSA-N
Melting Point 175-176C
Molecular Weight 365.05
Solvent Dimethyl sulfoxide-d6; Reference=TMS Spectrometer= Bruker AC-300
Synonyms THIOCYANIC ACID, 3,5-DIBROMO- 2-HYDROXY-4-METHYLPHENACYL ESTER