Dataset

electron ionisation mass spectrometry (EI-MS)

dataset for electron ionisation mass spectrometry (EI-MS)

Chemical Information

molecular Image
InChI InChI=1S/C11H20S2/c1-11(12-8-5-9-13-11)10-6-3-2-4-7-10/h10H,2-9H2,1H3
SMILES CC1(SCCCS1)C1CCCCC1
InChI Key RIZSGYIRFNODDH-UHFFFAOYSA-N
Molecular Formula C11H20S2
Exact Mass 216.407 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/RIZSGYIRFNODDH-UHFFFAOYSA-N/Mass/EI
License URL
Source https://www.chemotion-repository.net/inchikey/RIZSGYIRFNODDH-UHFFFAOYSA-N/Mass/EI
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataPublished 2014-05-27
Related Molecule
  • 2-cyclohexyl-2-methyl-1,3-dithiane
    • Field Value
    Measurement Technique electron ionisation mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    73427298 PubChem
    The data in this table is sourced from UniChem at EBI.