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S-(3,3-Dimethyl-2-hydroxy-but-1-yl)-N-methyl-S-phenyl-sulfoximine
SpectraBase Compound ID 3hkUrHt7dUb
InChI InChI=1S/C13H21NO2S/c1-13(2,3)12(15)10-17(16,14-4)11-8-6-5-7-9-11/h5-9,12,15H,10H2,1-4H3/t12?,17-/m0/s1
InChIKey MNMMSUMVJMWKAO-TYJDENFWSA-N
Mol Weight 255.38 g/mol
Molecular Formula C13H21NO2S
Exact Mass 255.1293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LxHWjk0ZDFa
Name S-(3,3-Dimethyl-2-hydroxy-but-1-yl)-N-methyl-S-phenyl-sulfoximine
Appearance Colourless powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 255.129300092 u
Formula C13H21NO2S
InChI InChI=1S/C13H21NO2S/c1-13(2,3)12(15)10-17(16,14-4)11-8-6-5-7-9-11/h5-9,12,15H,10H2,1-4H3/t12?,17-/m0/s1
InChIKey MNMMSUMVJMWKAO-TYJDENFWSA-N
Instrument Name Varian MAT 212 S
Ionization Type EI
Literature Reference DOI 10.1002/chem.201701881
Molecular Weight 255.376 g/mol
Quality 72
SMILES OC(C(C)(C)C)C[S@@](C1=CC=CC=C1)(=O)=NC
SPLASH splash10-0a6r-0900000000-62d0dfb4d407a99e1401
Sample Comments dr = 3.6:1
Source of Spectrum QE-23-SM4-25 (DOI: 10.1002/chem.201701881)
Wiley ID 1905948