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N-[(1R,2R)-2-bromanylcyclohexyl]-4-methyl-benzenesulfonamide
SpectraBase Compound ID 1ymTwt300LQ
InChI InChI=1S/C13H18BrNO2S/c1-10-6-8-11(9-7-10)18(16,17)15-13-5-3-2-4-12(13)14/h6-9,12-13,15H,2-5H2,1H3/t12-,13-/m1/s1
InChIKey KQFIHKIRTCZHAZ-CHWSQXEVSA-N
Mol Weight 332.26 g/mol
Molecular Formula C13H18BrNO2S
Exact Mass 331.024163 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G2x4huMOVd9
Name N-[(1R,2R)-2-bromanylcyclohexyl]-4-methyl-benzenesulfonamide
Alternate Name(s) N-[(1R,2R)-2-bromocyclohexyl]-4-methyl-benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18BrNO2S
InChI InChI=1S/C13H18BrNO2S/c1-10-6-8-11(9-7-10)18(16,17)15-13-5-3-2-4-12(13)14/h6-9,12-13,15H,2-5H2,1H3/t12-,13-/m1/s1
InChIKey KQFIHKIRTCZHAZ-CHWSQXEVSA-N
Molecular Weight 332.256 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)[C@]1([C@](Br)(CCCC1)[H])[H]
SPLASH splash10-06r7-9452000000-1b837dc8e6b5f10f3d55
Source of Spectrum H-84-672-2
Wiley ID 847519