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n-butyl 2-(methoxymethyl)phenyl sulfoxide
SpectraBase Compound ID CdXbeuVsyr8
InChI InChI=1S/C12H18O2S/c1-3-4-9-15(13)12-8-6-5-7-11(12)10-14-2/h5-8H,3-4,9-10H2,1-2H3
InChIKey IKBBASRMFNBWCU-UHFFFAOYSA-N
Mol Weight 226.33 g/mol
Molecular Formula C12H18O2S
Exact Mass 226.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1oOw1uDBpEs
Name n-butyl 2-(methoxymethyl)phenyl sulfoxide
Alternate Name(s) 1-(butylsulfinyl)-2-(methoxymethyl)benzene Butyl 2-(methoxymethyl)phenyl sulfoxide
CAS Registry Number 100790-04-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2S
InChI InChI=1S/C12H18O2S/c1-3-4-9-15(13)12-8-6-5-7-11(12)10-14-2/h5-8H,3-4,9-10H2,1-2H3
InChIKey IKBBASRMFNBWCU-UHFFFAOYSA-N
Molecular Weight 226.334 g/mol
SMILES c1(S(=O)CCCC)c(COC)cccc1
SPLASH splash10-000l-5900000000-d6ab81b51bce4a22c38e
Source of Spectrum J-51-1039-16
Wiley ID 1227206