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(3R,SS)-N-(tert-Butanesulfinyl)-1-(2-bromophenyl)octan-3-amine
SpectraBase Compound ID BX90yHmMlvk
InChI InChI=1S/C18H30BrNOS/c1-5-6-7-11-16(20-22(21)18(2,3)4)14-13-15-10-8-9-12-17(15)19/h8-10,12,16,20H,5-7,11,13-14H2,1-4H3/t16-,22?/m1/s1
InChIKey GETKPQINHDYCKQ-XESZBRCGSA-N
Mol Weight 388.41 g/mol
Molecular Formula C18H30BrNOS
Exact Mass 387.123149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ik7mrRQ6emp
Name (3R,SS)-N-(tert-Butanesulfinyl)-1-(2-bromophenyl)octan-3-amine
Alternate Name(s) (S)-N-((R)-1-(2-bromophenyl)octan-3-yl)-2-methylpropane-2-sulfinamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H30BrNOS
InChI InChI=1S/C18H30BrNOS/c1-5-6-7-11-16(20-22(21)18(2,3)4)14-13-15-10-8-9-12-17(15)19/h8-10,12,16,20H,5-7,11,13-14H2,1-4H3/t16-,22?/m1/s1
InChIKey GETKPQINHDYCKQ-XESZBRCGSA-N
Literature Reference DOI 10.3987/COM-13-S(S)75
Molecular Weight 388.408 g/mol
SMILES N([C@@](CCc1c(cccc1)Br)(CCCCC)[H])[S@@](=O)C(C)(C)C
SPLASH splash10-0f7k-3910000000-3cc0228d2474b3d0de53
Source of Spectrum H1-88-1168-9
Wiley ID 1746470