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3-methoxy-3-methylbutyl 4-methylbenzenesulfonate
SpectraBase Compound ID EovXBNqMw80
InChI InChI=1S/C13H20O4S/c1-11-5-7-12(8-6-11)18(14,15)17-10-9-13(2,3)16-4/h5-8H,9-10H2,1-4H3
InChIKey LIDDRRXORKZDBY-UHFFFAOYSA-N
Mol Weight 272.36 g/mol
Molecular Formula C13H20O4S
Exact Mass 272.10823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E6c5csV1KW7
Name 3-methoxy-3-methylbutyl 4-methylbenzenesulfonate
Appearance Light yellow liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O4S
InChI InChI=1S/C13H20O4S/c1-11-5-7-12(8-6-11)18(14,15)17-10-9-13(2,3)16-4/h5-8H,9-10H2,1-4H3
InChIKey LIDDRRXORKZDBY-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 272.359 g/mol
SMILES c1(ccc(C)cc1)S(OCCC(OC)(C)C)(=O)=O
SPLASH splash10-00dr-9000000000-f789abfad6a17ee15405
Source of Spectrum WO2010002386A1
Wiley ID 1842697