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

Formula: C15H18OS2


Canonical SMILES:
CC(=C1SCCS1)C(c1ccccc1)CC(=O)C
InChI:
InChI=1S/C15H18OS2/c1-11(16)10-14(13-6-4-3-5-7-13)12(2)15-17-8-9-18-15/h3-7,14H,8-10H2,1-2H3
InChIKey:
VWZGXEMKFJLYLX-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2018-04-28This work is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.

 

mass spectrometry (MS) 
Author: Simone Gräßle
Analysis DOI:
Analysis ID:
Content:   
EI (m/z, 70 eV, 60 °C): 278 (82) [M]+, 221 (100), 198 (32), 170 (86), 161 (50), 131 (24), 58 (28); HRMS–EI (m/z): [M]+ calcd for C15H18O2S2, 278.0794; found, 278.0796.
Datasets