Dataset

high-resolution mass spectrometry (HRMS)

dataset for high-resolution mass spectrometry (HRMS)

Chemical Information

molecular Image
InChI InChI=1S/C12H18O2/c1-12(2,3)14-10-9-13-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3
SMILES CC(OCCOc1ccccc1)(C)C
InChI Key YZTHITMFRXMZHV-UHFFFAOYSA-N
Exact Mass 194.270 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/YZTHITMFRXMZHV-UHFFFAOYSA-N/CHMO0000498
License URL
Source https://www.chemotion-repository.net/inchikey/YZTHITMFRXMZHV-UHFFFAOYSA-N/CHMO0000498
Version
Author Burkhard Koenig
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-02-26
Related Molecule
  • 2-[(2-methylpropan-2-yl)oxy]ethoxybenzene
    • Field Value
    Measurement Technique high-resolution mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    3005466 surechembl
    20768982 pubchem
    The data in this table is sourced from UniChem at EBI.