This information is based on the molecular structure shown on the left side. For a decoupled sample, please refer to its individual details.

Formula: C11H14O3S


Canonical SMILES:
CC(OS(=O)(=O)/C=C/c1ccccc1)C
InChI:
InChI=1S/C11H14O3S/c1-10(2)14-15(12,13)9-8-11-6-4-3-5-7-11/h3-10H,1-2H3/b9-8+
InChIKey:
OPTQKNRBAMBSSR-CMDGGOBGSA-N
Exact Mass:
Crosslinks:   


Published on 2024-10-15This work is licensed under a Creative Commons Attribution 4.0 International License.

 

mass spectrometry (MS) 
Authors: Po-Chung Chien1 - Georg Manolikakes2

1. Chemistry, RPTU Kaiserslautern, Germany

2. Department of Chemistry, RPTU Kaiserslautern-Landau, Germany

Analysis DOI:
Analysis ID:
Content:   
MS (APCI, m/z): 228 (7), 227 (9) [M+H]+, 187 (5), 186 (75), 185 (100), 167 (8), 104 (5), 103 (11). HRMS (EI+, m/z): [M]+ calc. for C11H14O3S 226.0664; found 226.0675.
Datasets