Dataset

high-resolution mass spectrometry (HRMS)

dataset for high-resolution mass spectrometry (HRMS)

Chemical Information

molecular Image
InChI InChI=1S/C22H24O4/c1-22(2,3)16-12-19(25-5)18-11-15(21(23)26-20(18)13-16)10-14-6-8-17(24-4)9-7-14/h6-9,11-13H,10H2,1-5H3
SMILES COc1cc(cc2c1cc(Cc1ccc(cc1)OC)c(=O)o2)C(C)(C)C
InChI Key JAKJGLBCAUIJIV-UHFFFAOYSA-N
Exact Mass 352.424 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/JAKJGLBCAUIJIV-UHFFFAOYSA-N/CHMO0000498
License URL
Source https://www.chemotion-repository.net/inchikey/JAKJGLBCAUIJIV-UHFFFAOYSA-N/CHMO0000498
Version
Author Florian Mohr
Maintainer Chemotion Repository
Language english
MetadataPublished 2026-04-28T13:07:33Z
Related Molecule
  • nfdi4chem-mol5821 (Unknown Molecule)
    • Field Value
    Measurement Technique high-resolution mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.