Dataset

electron ionisation mass spectrometry (EI-MS)

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

Chemical Info

molecular Image
InChI InChI=1S/C13H10F2/c14-13(15)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9,13H
SMILES FC(c1ccc(cc1)c1ccccc1)F
InChI Key BPLWLYWRZQYGSG-UHFFFAOYSA-N
Molecular Formula C13H10F2
Exact Mass 204.215 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BPLWLYWRZQYGSG-UHFFFAOYSA-N/CHMO0000480
License URL
Source https://www.chemotion-repository.net/inchikey/BPLWLYWRZQYGSG-UHFFFAOYSA-N/CHMO0000480
Version
Author Sylvia Vanderheiden-Schroen
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T04:28:57.537426
MetadataModified 2024-09-07T19:41:36.233312
MetadataPublished 2021-05-13
Field Value
Measurement Technique electron ionisation mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
SCHEMBL4637121 SureChEMBL
188636 ChEBI
124342423 PubChem: Thomson Pharma
15040199 PubChem
J3.029.956F Nikkaji
The data in this table is sourced from UniChem at EBI.