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2-Hydroxyethyl 4-methylbenzenesulfonate

View entire compound with spectra: 2 MS (GC)

2-Hydroxyethyl 4-methylbenzenesulfonate
SpectraBase Compound ID HhlY33yHhWT
InChI InChI=1S/C9H12O4S/c1-8-2-4-9(5-3-8)14(11,12)13-7-6-10/h2-5,10H,6-7H2,1H3
InChIKey DZVSAHOHDQUFMZ-UHFFFAOYSA-N
Mol Weight 216.25 g/mol
Molecular Formula C9H12O4S
Exact Mass 216.04563 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2HB35PklKRd
Name 2-Hydroxyethyl 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O4S
InChI InChI=1S/C9H12O4S/c1-8-2-4-9(5-3-8)14(11,12)13-7-6-10/h2-5,10H,6-7H2,1H3
InChIKey DZVSAHOHDQUFMZ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201310280
Molecular Weight 216.251 g/mol
SMILES OCCOS(=O)(c1ccc(cc1)C)=O
SPLASH splash10-052f-9700000000-9406cf9900c8d72644cf
Source of Spectrum ACI-53-SMS21-S3a
Wiley ID 1782132