Dataset

electron ionisation mass spectrometry (EI-MS)

dataset for electron ionisation mass spectrometry (EI-MS)

Chemical Information

molecular Image
InChI InChI=1S/C16H14O2/c1-11-8-12(2)10-14(9-11)16(18)15(17)13-6-4-3-5-7-13/h3-10H,1-2H3
SMILES Cc1cc(C)cc(c1)C(=O)C(=O)c1ccccc1
InChI Key FLDZKKZKDQBGPT-UHFFFAOYSA-N
Exact Mass 238.281 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/FLDZKKZKDQBGPT-UHFFFAOYSA-N/CHMO0000480
License URL
Source https://www.chemotion-repository.net/inchikey/FLDZKKZKDQBGPT-UHFFFAOYSA-N/CHMO0000480
Version
Author Stefan Bräse
Maintainer Chemotion Repository
Language english
MetadataPublished 2026-02-03
Related Molecule
Field Value
Measurement Technique electron ionisation mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
21662110 pubchem
The data in this table is sourced from UniChem at EBI.