Dataset

electron ionisation mass spectrometry (EI-MS)

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

Chemical Info

molecular Image
InChI InChI=1S/C16H16O4/c1-11-4-9-14(15(10-11)18-2)20-13-7-5-12(6-8-13)16(17)19-3/h4-10H,1-3H3
SMILES COC(=O)c1ccc(cc1)Oc1ccc(cc1OC)C
InChI Key MFKBBLHMVNUYBZ-UHFFFAOYSA-N
Molecular Formula C16H16O4
Exact Mass 272.296 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/MFKBBLHMVNUYBZ-UHFFFAOYSA-N/Mass/EI
License URL
Source https://www.chemotion-repository.net/inchikey/MFKBBLHMVNUYBZ-UHFFFAOYSA-N/Mass/EI
Version
Author Nicole Jung
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-06T23:35:15.629052
MetadataModified 2024-09-07T12:49:15.961765
MetadataPublished 2014-05-27
Field Value
Measurement Technique electron ionisation mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
73427442 PubChem
The data in this table is sourced from UniChem at EBI.