Dataset

high-performance liquid chromatography-mass spectrometry (HPLC-MS)

dataset for high-performance liquid chromatography-mass spectrometry (HPLC-MS)

Chemical Information

molecular Image
InChI InChI=1S/C11H10N2O3S/c1-7-11(14)12-10(17-7)6-8-2-4-9(5-3-8)13(15)16/h2-7H,1H3,(H,12,14)/b10-6-
SMILES O=C1N/C(=C/c2ccc(cc2)[N+](=O)[O-])/SC1C
InChI Key PGDGUAOXLLTZJC-POHAHGRESA-N
Molecular Formula C11H10N2O3S
Exact Mass 250.274 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/PGDGUAOXLLTZJC-POHAHGRESA-N/CHMO0000796
License URL
Source https://www.chemotion-repository.net/inchikey/PGDGUAOXLLTZJC-POHAHGRESA-N/CHMO0000796
Version
Author Eric Täuscher
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-11-07
Related Molecule
  • (2Z)-5-methyl-2-[(4-nitrophenyl)methylidene]-1,3-thiazolidin-4-one
    • Field Value
    Measurement Technique high-performance liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    168720030 PubChem
    The data in this table is sourced from UniChem at EBI.