Dataset

mass spectrometry (MS)

dataset for mass spectrometry (MS)

Chemical Information

molecular Image
InChI InChI=1S/C10H13NO3/c1-7(12)11-9-6-8(13-2)4-5-10(9)14-3/h4-6H,1-3H3,(H,11,12)
SMILES COc1ccc(c(c1)NC(=O)C)OC
InChI Key HOZRMSVNIKYCMB-UHFFFAOYSA-N
Molecular Formula C10H13NO3
Exact Mass 195.215 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HOZRMSVNIKYCMB-UHFFFAOYSA-N/Mass
License URL
Source https://www.chemotion-repository.net/inchikey/HOZRMSVNIKYCMB-UHFFFAOYSA-N/Mass
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataPublished 2018-09-10
Related Molecule
  • N-(2,5-dimethoxyphenyl)acetamide
    • Field Value
    Measurement Technique mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    2502603 surechembl
    77015 pubchem
    BQT642LWE1 fdasrs
    Molport-001-020-029 molport
    The data in this table is sourced from UniChem at EBI.