Dataset

electron ionisation mass spectrometry (EI-MS)

dataset for electron ionisation mass spectrometry (EI-MS)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C9H6F3NO2S2/c10-9(11,12)5-17(14,15)8-13-6-3-1-2-4-7(6)16-8/h1-4H,5H2
SMILES FC(CS(=O)(=O)c1nc2c(s1)cccc2)(F)F
InChI Key QFJHELHCAJODHK-UHFFFAOYSA-N
Molecular Formula C9H6F3NO2S2
Exact Mass 281.275 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/QFJHELHCAJODHK-UHFFFAOYSA-N/Mass/EI
License URL
Source https://www.chemotion-repository.net/inchikey/QFJHELHCAJODHK-UHFFFAOYSA-N/Mass/EI
Version
Author Andreas Hafner
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-06T23:26:45.316105
MetadataModified 2024-09-07T12:36:27.444049
MetadataPublished 2014-05-27
Field Value
Measurement Technique electron ionisation mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
72792712 PubChem
The data in this table is sourced from UniChem at EBI.