Dataset

mass spectrometry (MS)

dataset for mass spectrometry (MS)

Chemical Information

molecular Image
InChI InChI=1S/C26H26O4/c1-15-11-19(25(27)29-5)7-9-21(15)23-13-18(4)24(14-17(23)3)22-10-8-20(12-16(22)2)26(28)30-6/h7-14H,1-6H3
SMILES COC(=O)c1ccc(c(c1)C)c1cc(C)c(cc1C)c1ccc(cc1C)C(=O)OC
InChI Key LYGYIMCBJYUIQT-UHFFFAOYSA-N
Molecular Formula C26H26O4
Exact Mass 402.482 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/LYGYIMCBJYUIQT-UHFFFAOYSA-N/CHMO0000470
License URL
Source https://www.chemotion-repository.net/inchikey/LYGYIMCBJYUIQT-UHFFFAOYSA-N/CHMO0000470
Version
Author Sylvain Grosjean
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-08-08
Related Molecule
  • methyl 4-[4-(4-methoxycarbonyl-2-methylphenyl)-2,5-dimethylphenyl]-3-methylbenzoate
    • Field Value
    Measurement Technique mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    101562712 pubchem
    The data in this table is sourced from UniChem at EBI.