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

Formula: C18H24OS2


Canonical SMILES:
CCCCC(C(=C1SCCS1)c1ccccc1)CC(=O)C
InChI:
InChI=1S/C18H24OS2/c1-3-4-8-16(13-14(2)19)17(18-20-11-12-21-18)15-9-6-5-7-10-15/h5-7,9-10,16H,3-4,8,11-13H2,1-2H3
InChIKey:
XLPWXCGXHOGTNX-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, 120 °C): 320 (58) [M]+, 263 (100), 221 (22), 195 (20), 152 (49); HRMS–EI (m/z): [M]+ calcd for C18H24OS2, 320.1263; found, 320.1265.
Datasets