Dataset

electron ionisation mass spectrometry (EI-MS)

dataset for electron ionisation mass spectrometry (EI-MS)

Chemical Information

molecular Image
InChI InChI=1S/C19H18F2O4/c20-19(21,11-13-24-17(22)15-7-3-1-4-8-15)12-14-25-18(23)16-9-5-2-6-10-16/h1-10H,11-14H2
SMILES O=C(c1ccccc1)OCCC(CCOC(=O)c1ccccc1)(F)F
InChI Key CGCVSZLNAIIXGT-UHFFFAOYSA-N
Molecular Formula C19H18F2O4
Exact Mass 348.341 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/CGCVSZLNAIIXGT-UHFFFAOYSA-N/Mass/EI.1
License URL
Source https://www.chemotion-repository.net/inchikey/CGCVSZLNAIIXGT-UHFFFAOYSA-N/Mass/EI.1
Version
Author Frederic Witkind Hirth
Maintainer Chemotion Repository
Language english
MetadataPublished 2014-08-19
Related Molecule
  • (5-benzoyloxy-3,3-difluoropentyl) benzoate
    • Field Value
    Measurement Technique electron ionisation mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    14451051 PubChem
    The data in this table is sourced from UniChem at EBI.