Dataset

SULFANILAMIDE

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP006291 contains the MS mass spectrum of SULFANILAMIDE with the InChIkey FDDDEECHVMSUSB-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C6H8N2O2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)
SMILES	Nc(c1)ccc(c1)S(N)(=O)=O
InChI Key	FDDDEECHVMSUSB-UHFFFAOYSA-N
Molecular Formula	C6H8N2O2S
Exact Mass	172.031 g/mol

Data and Resources

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Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-nc-sa/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP006291
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T15:55:33.312875
MetadataModified	2024-01-11T15:55:33.479616
MetadataPublished	2016-01-19

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
MCULE-8746683155	Mcule
SCHEMBL740	SureChEMBL
SULAMD	CCDC
J4.829A	Nikkaji
10008876	NMRShiftDB
45373	ChEBI
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
129828936	PubChem
75654	Brenda
108364	Brenda
42531	Brenda
2606	Brenda
14624	Brenda
1096	Brenda
25096	Brenda
HMDB0014404	Human Metabolome Database
CB6212562	ChemicalBook
sulfanilamide	DailyMed
226958	Brenda
ZINC000000002101	ZINC
10857	BindingDB
SULFANILAMIDE	rxnorm
SULFANILAMIDE	clinicaltrials
HY-B0242	MedChemExpress
DTXSID4023622	EPA CompTox Dashboard
2521	DrugCentral
C07458	KEGG Ligand
DB00259	DrugBank
CHEMBL21	ChEMBL
SAN	PDBe
474316	eMolecules
The data in this table is sourced from UniChem at EBI.