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N-[(2S,3R)-(2-Chlorotetrahydropyran-3-yl)-N-dimethylbenzenesulfonamide
SpectraBase Compound ID 18e0GglLnxj
InChI InChI=1S/C13H18ClNO3S/c1-10-5-7-11(8-6-10)19(16,17)15(2)12-4-3-9-18-13(12)14/h5-8,12-13H,3-4,9H2,1-2H3/t12-,13-/m1/s1
InChIKey LWRKBEJKVCYGQO-CHWSQXEVSA-N
Mol Weight 303.8 g/mol
Molecular Formula C13H18ClNO3S
Exact Mass 303.069592 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FRL95Rebd8O
Name N-[(2S,3R)-(2-Chlorotetrahydropyran-3-yl)-N-dimethylbenzenesulfonamide
Appearance Yellow oil
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Formula C13H18ClNO3S
InChI InChI=1S/C13H18ClNO3S/c1-10-5-7-11(8-6-10)19(16,17)15(2)12-4-3-9-18-13(12)14/h5-8,12-13H,3-4,9H2,1-2H3/t12-,13-/m1/s1
InChIKey LWRKBEJKVCYGQO-CHWSQXEVSA-N
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.11.136
Molecular Weight 303.804 g/mol
Reported Formula C13H18N(35)ClO3S
SMILES [C@]1(Cl)(OCCC[C@]1(N(S(c1ccc(cc1)C)(=O)=O)C)[H])[H]
SPLASH splash10-0a4i-5913000000-67b89883216549d96a33
Source of Spectrum BJO-11-1232-12
Thin-Layer Chromatography Rf = 0.21 (pentane/ether, 3:1)
Wiley ID 1851486