Dataset

high-resolution mass spectrometry (HRMS)

dataset for high-resolution mass spectrometry (HRMS)

Chemical Information

molecular Image
InChI InChI=1S/C13H15NO2/c1-14-6-4-5-13(14)10-7-11(15-2)9-12(8-10)16-3/h4-9H,1-3H3
SMILES COc1cc(OC)cc(c1)c1cccn1C
InChI Key URVNXNVIZKOMRD-UHFFFAOYSA-N
Molecular Formula C13H15NO2
Exact Mass 217.264 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/URVNXNVIZKOMRD-UHFFFAOYSA-N/CHMO0000498
License URL
Source https://www.chemotion-repository.net/inchikey/URVNXNVIZKOMRD-UHFFFAOYSA-N/CHMO0000498
Version
Author Robert Wolf
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-05-14
Related Molecule
  • 2-(3,5-dimethoxyphenyl)-1-methylpyrrole
    • Field Value
    Measurement Technique high-resolution mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    117692354 PubChem: Thomson Pharma
    51032281 PubChem
    J3.522.389D Nikkaji
    The data in this table is sourced from UniChem at EBI.