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1-[1-Chloro-1-(p-tolylsulfinyl)undecyl]-1-cyclobutanol
SpectraBase Compound ID I2WFmPL7Wpn
InChI InChI=1S/C22H35ClO2S/c1-3-4-5-6-7-8-9-10-18-22(23,21(24)16-11-17-21)26(25)20-14-12-19(2)13-15-20/h12-15,24H,3-11,16-18H2,1-2H3
InChIKey XFBVBQKDFRNLNV-UHFFFAOYSA-N
Mol Weight 399.0 g/mol
Molecular Formula C22H35ClO2S
Exact Mass 398.204629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ID4eeTDjNf
Name 1-[1-Chloro-1-(p-tolylsulfinyl)undecyl]-1-cyclobutanol
Alternate Name(s) 1-{1-chloro-1-[(4-methylphenyl)sulfinyl]undecyl}cyclobutanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H35ClO2S
InChI InChI=1S/C22H35ClO2S/c1-3-4-5-6-7-8-9-10-18-22(23,21(24)16-11-17-21)26(25)20-14-12-19(2)13-15-20/h12-15,24H,3-11,16-18H2,1-2H3
InChIKey XFBVBQKDFRNLNV-UHFFFAOYSA-N
Molecular Weight 399.033 g/mol
SMILES OC1(CCC1)C(CCCCCCCCCC)(S(=O)c1ccc(cc1)C)Cl
SPLASH splash10-0006-0900000000-128caa052333cfa107ea
Source of Spectrum F-50-11847-13
Wiley ID 789635