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(3S)-syn-2,5-Dimethyl-3-[N-(4-methoxybenzyl)-N-tosylamino]hexan-1-ol
SpectraBase Compound ID 9o0fw9yWjeX
InChI InChI=1S/C23H33NO4S/c1-17(2)14-23(19(4)16-25)24(15-20-8-10-21(28-5)11-9-20)29(26,27)22-12-6-18(3)7-13-22/h6-13,17,19,23,25H,14-16H2,1-5H3/t19?,23-/m0/s1
InChIKey BESHOQMKMAGNHG-BVHINDKJSA-N
Mol Weight 419.6 g/mol
Molecular Formula C23H33NO4S
Exact Mass 419.21303 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1bPobllCEq5
Name (3S)-syn-2,5-Dimethyl-3-[N-(4-methoxybenzyl)-N-tosylamino]hexan-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H33NO4S
InChI InChI=1S/C23H33NO4S/c1-17(2)14-23(19(4)16-25)24(15-20-8-10-21(28-5)11-9-20)29(26,27)22-12-6-18(3)7-13-22/h6-13,17,19,23,25H,14-16H2,1-5H3/t19?,23-/m0/s1
InChIKey BESHOQMKMAGNHG-BVHINDKJSA-N
Molecular Weight 419.580 g/mol
SMILES OCC([C@@](N(S(c1ccc(cc1)C)(=O)=O)Cc1ccc(cc1)OC)(CC(C)C)[H])C
SPLASH splash10-006x-8901000000-bad08a99b6e782c45d30
Source of Spectrum J-58-4761-6
Synonyms (3S)-anti-2,5-Dimethyl-3-[N-(4-methoxybenzyl)-N-tosylamino]hexan-1-ol N-[(1S)-1-(2-hydroxy-1-methylethyl)-3-methylbutyl]-N-(4-methoxybenzyl)-4-methylbenzenesulfonamide
Wiley ID 1377604