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5-chloro-3-methylbenzo[b]thien-2-yl hydroxymethyl ketone, 2,4-dichlorobenzoate
SpectraBase Compound ID JVvKBIVCuFs
InChI InChI=1S/C18H11Cl3O3S/c1-9-13-6-10(19)3-5-16(13)25-17(9)15(22)8-24-18(23)12-4-2-11(20)7-14(12)21/h2-7H,8H2,1H3
InChIKey UVZSRIUENWKIMN-UHFFFAOYSA-N
Mol Weight 413.7 g/mol
Molecular Formula C18H11Cl3O3S
Exact Mass 411.949448 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6QnXA0y8Bvu
Name 5-chloro-3-methylbenzo[b]thien-2-yl hydroxymethyl ketone, 2,4-dichlorobenzoate
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H11Cl3O3S
InChI InChI=1S/C18H11Cl3O3S/c1-9-13-6-10(19)3-5-16(13)25-17(9)15(22)8-24-18(23)12-4-2-11(20)7-14(12)21/h2-7H,8H2,1H3
InChIKey UVZSRIUENWKIMN-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 55812M
Solvent CDCl3