Dataset

Sulfanilamide

This MassBank record with Accession MSBNK-Athens_Univ-AU102202 contains the MS2 mass spectrum of Sulfanilamide with the InChIkey FDDDEECHVMSUSB-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C6H8N2O2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)
SMILES c1cc(ccc1N)S(=O)(=O)N
InChI Key FDDDEECHVMSUSB-UHFFFAOYSA-N
Molecular Formula C6H8N2O2S
Exact Mass 172.031 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU102202
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:51:56.827568
MetadataModified 2025-02-08T19:11:33.260100
MetadataPublished 2015-07-05
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
5333 PubChem
PD001658 ProbesDrugs
21240MF57M FDA SRS
LSM-6524 LINCS
14748191 PubChem: Thomson Pharma
63-74-1 ACToR
PA451545 PharmGKB
Sulfanilamide Selleck
102489-34-9 ACToR
474316 eMolecules
10008876 NMRShiftDB
MCULE-8746683155 Mcule
SCHEMBL740 SureChEMBL
45373 ChEBI
42531 Brenda
2606 Brenda
14624 Brenda
1096 Brenda
25096 Brenda
HMDB0014404 Human Metabolome Database
CB6212562 ChemicalBook
sulfanilamide DailyMed
75654 Brenda
108364 Brenda
DB00259 DrugBank
CHEMBL21 ChEMBL
SAN PDBe
C07458 KEGG Ligand
129828936 PubChem
226958 Brenda
SULFANILAMIDE rxnorm
SULFANILAMIDE clinicaltrials
HY-B0242 MedChemExpress
10857 BindingDB
2521 DrugCentral
ZINC000000002101 ZINC
J4.829A Nikkaji
SULAMD CCDC
DTXSID4023622 EPA CompTox Dashboard
The data in this table is sourced from UniChem at EBI.