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2,2-DIMETHYL-TRANS-6-PARA-CHLOROPHENYL-R-4-AMINOTHIANE
SpectraBase Compound ID IujMaPSowa3
InChI InChI=1S/C13H18ClNS/c1-13(2)8-11(15)7-12(16-13)9-3-5-10(14)6-4-9/h3-6,11-12H,7-8,15H2,1-2H3/t11-,12-/m1/s1
InChIKey IIAJOEOCYJTZER-VXGBXAGGSA-N
Mol Weight 255.81 g/mol
Molecular Formula C13H18ClNS
Exact Mass 255.084848 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Aj6qw3l2oyG
Name 2,2-DIMETHYL-TRANS-6-PARA-CHLOROPHENYL-R-4-AMINOTHIANE
CAS Registry Number 78837-46-4
Compound Number 2F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18ClNS
InChI InChI=1S/C13H18ClNS/c1-13(2)8-11(15)7-12(16-13)9-3-5-10(14)6-4-9/h3-6,11-12H,7-8,15H2,1-2H3/t11-,12-/m1/s1
InChIKey IIAJOEOCYJTZER-VXGBXAGGSA-N
Literature Reference Author P.K.SUBRAMANIAN,K.RAMALINGAM,N.SATYAMURTHY,K.D.BERLIN
Literature Reference Citation J.ORG.CHEM.,46,4376(1981)
Literature Reference DOI 10.1021/jo00335a011
Molecular Weight 255.806 g/mol
Solvent CDCl3
Source File Reference UWWR481