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3-(3,5-dimethoxyphenyl)-2-butyl methanesulfonate (7a)
SpectraBase Compound ID 2zrNJMKkjNf
InChI InChI=1S/C13H20O5S/c1-9(10(2)18-19(5,14)15)11-6-12(16-3)8-13(7-11)17-4/h6-10H,1-5H3
InChIKey IBPJJQDEUCOUAJ-UHFFFAOYSA-N
Mol Weight 288.36 g/mol
Molecular Formula C13H20O5S
Exact Mass 288.103145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HOsAg1iNz3l
Name 3-(3,5-dimethoxyphenyl)-2-butyl methanesulfonate (7a)
Alternate Name(s) 3-(3,5-dimethoxyphenyl)-2-butyl methanesulfonate 2-(3,5-dimethoxyphenyl)-1-methylpropyl methanesulfonate
CAS Registry Number 122903-53-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O5S
InChI InChI=1S/C13H20O5S/c1-9(10(2)18-19(5,14)15)11-6-12(16-3)8-13(7-11)17-4/h6-10H,1-5H3
InChIKey IBPJJQDEUCOUAJ-UHFFFAOYSA-N
Molecular Weight 288.358 g/mol
SMILES C(OS(=O)(=O)C)(C(c1cc(OC)cc(c1)OC)C)C
SPLASH splash10-03dr-0930000000-ded03dcce84635922138
Source of Spectrum C-111-8210-7
Wiley ID 1291416