Dataset

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

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

Chemical Info

molecular Image
InChI InChI=1S/C12H12N2O3S/c1-3-17-11-8(2)18-12(13-11)9-5-4-6-10(7-9)14(15)16/h4-7H,3H2,1-2H3
SMILES CCOc1nc(sc1C)c1cccc(c1)[N+](=O)[O-]
InChI Key ONTUWPYKFSIHQE-UHFFFAOYSA-N
Molecular Formula C12H12N2O3S
Exact Mass 264.300 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/ONTUWPYKFSIHQE-UHFFFAOYSA-N/CHMO0000796
License URL
Source https://www.chemotion-repository.net/inchikey/ONTUWPYKFSIHQE-UHFFFAOYSA-N/CHMO0000796
Version
Author Eric Täuscher
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T01:05:39.055536
MetadataModified 2024-09-08T01:05:39.055541
MetadataPublished 2023-07-18
Field Value
Measurement Technique high-performance liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
168430088 PubChem
The data in this table is sourced from UniChem at EBI.