This information is based on the molecular structure shown on the left side. For a decoupled sample, please refer to its individual details.
Formula: C13H24O3S
Canonical SMILES:
OC(=O)CCCCCCCCCCSC(=O)C
InChI:
InChI=1S/C13H24O3S/c1-12(14)17-11-9-7-5-3-2-4-6-8-10-13(15)16/h2-11H2,1H3,(H,15,16)
InChIKey:
DHKWYRRJFXRZOA-UHFFFAOYSA-N
Exact Mass:
Crosslinks: 