Dataset

electron ionisation mass spectrometry (EI-MS)

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

Chemical Info

molecular Image
InChI InChI=1S/C13H15F3/c1-12(2,3)11-6-4-10(5-7-11)8-9-13(14,15)16/h4-9H,1-3H3
SMILES FC(C=Cc1ccc(cc1)C(C)(C)C)(F)F
InChI Key QAHIAMLOAHKKKG-UHFFFAOYSA-N
Molecular Formula C13H15F3
Exact Mass 228.253 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/QAHIAMLOAHKKKG-UHFFFAOYSA-N/Mass/EI
License URL
Source https://www.chemotion-repository.net/inchikey/QAHIAMLOAHKKKG-UHFFFAOYSA-N/Mass/EI
Version
Author Andreas Hafner
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-06T23:29:05.954179
MetadataModified 2024-09-07T12:40:02.323296
MetadataPublished 2014-05-27
Field Value
Measurement Technique electron ionisation mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
73427424 PubChem
The data in this table is sourced from UniChem at EBI.