Dataset

electron ionisation mass spectrometry (EI-MS)

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

Chemical Info

molecular Image
InChI InChI=1S/C20H20O4/c1-22-17-8-9-18(23-2)20-16(17)10-15(12-21)11-19(20)24-13-14-6-4-3-5-7-14/h3-11,21H,12-13H2,1-2H3
SMILES OCc1cc(OCc2ccccc2)c2c(c1)c(OC)ccc2OC
InChI Key MBAJIMZHZXAKNG-UHFFFAOYSA-N
Molecular Formula C20H20O4
Exact Mass 324.370 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/MBAJIMZHZXAKNG-UHFFFAOYSA-N/Mass/EI
License URL
Source https://www.chemotion-repository.net/inchikey/MBAJIMZHZXAKNG-UHFFFAOYSA-N/Mass/EI
Version
Author Tim Wezeman
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T00:06:30.039626
MetadataModified 2024-09-07T13:35:43.115619
MetadataPublished 2014-05-27
Field Value
Measurement Technique electron ionisation mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
73427511 PubChem
NISHAA CCDC
The data in this table is sourced from UniChem at EBI.