Dataset

mass spectrometry (MS) (diethyl benzene-1,4-dicarboxylate)

dataset for mass spectrometry (MS)

Chemical Info

molecular Image
InChI InChI=1S/C12H14O4/c1-3-15-11(13)9-5-7-10(8-6-9)12(14)16-4-2/h5-8H,3-4H2,1-2H3
SMILES CCOC(=O)c1ccc(C(=O)OCC)cc1
InChI Key ONIHPYYWNBVMID-UHFFFAOYSA-N
Molecular Formula C12H14O4
Exact Mass 222.240 g/mol

Data and Resources

Related Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source
Version
Author Grosjean, Sylvain
Maintainer chemotion.net
Language en
MetadataCreated 2022-10-06T16:31:05.068885
MetadataModified 2022-10-06T16:31:05.068890
MetadataPublished
Field Value
Measurement Technique
Measurement Variables