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6-(4-Chloro-benzylthiothiocarbonyl)-1,3,3-trimethyl-6-aza-bicyclo(3.2.1)octane
SpectraBase Compound ID KQsjQVBK6L3
InChI InChI=1S/C18H24ClNS2/c1-17(2)8-15-9-18(3,11-17)12-20(15)16(21)22-10-13-4-6-14(19)7-5-13/h4-7,15H,8-12H2,1-3H3
InChIKey ACDVHVVUBJQLSB-UHFFFAOYSA-N
Mol Weight 353.97 g/mol
Molecular Formula C18H24ClNS2
Exact Mass 353.10387 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2tqfi0tz0zm
Name 6-(4-Chloro-benzylthiothiocarbonyl)-1,3,3-trimethyl-6-aza-bicyclo(3.2.1)octane
CAS Registry Number 101132-71-2
Comments ROTAMER B
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H24ClNS2
InChI InChI=1S/C18H24ClNS2/c1-17(2)8-15-9-18(3,11-17)12-20(15)16(21)22-10-13-4-6-14(19)7-5-13/h4-7,15H,8-12H2,1-3H3
InChIKey ACDVHVVUBJQLSB-UHFFFAOYSA-N
Instrument Name Bruker WM-250
Literature Reference P. Sohar, I. Pelczer, I. Vaczi, A. Tombor, Magn. Res. Chem. 23, 506 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3