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3-(3,4-Dichlorobenzyl)-8-thia-3-azabicyclo[3.2.1]octane-2,4-dione

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

3-(3,4-Dichlorobenzyl)-8-thia-3-azabicyclo[3.2.1]octane-2,4-dione
SpectraBase Compound ID Jgemt4YmWv6
InChI InChI=1S/C13H11Cl2NO2S/c14-8-2-1-7(5-9(8)15)6-16-12(17)10-3-4-11(19-10)13(16)18/h1-2,5,10-11H,3-4,6H2
InChIKey VOQWISYOZKUWGI-UHFFFAOYSA-N
Mol Weight 316.2 g/mol
Molecular Formula C13H11Cl2NO2S
Exact Mass 314.988755 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B90AQZ2ZFvT
Name 3-(3,4-dichlorobenzyl)-8-thia-3-azabicyclo[3.2.1]octane-2,4-dione
Source of Sample R. N. Prasad, Abbott Laboratories, Ltd., Montreal, Canada
Copyright Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11Cl2NO2S
InChI InChI=1S/C13H11Cl2NO2S/c14-8-2-1-7(5-9(8)15)6-16-12(17)10-3-4-11(19-10)13(16)18/h1-2,5,10-11H,3-4,6H2
InChIKey VOQWISYOZKUWGI-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 5167M
Solvent CDCl3
Synonyms 8-THIA-3-AZABICYCLO/3.2.1/OCTANE-2,4- DIONE, 3-/3,4-DICHLOROBENZYL/-,