Dataset

Sulfamethoxypyridazine

This MassBank record with Accession MSBNK-Athens_Univ-AU101503 contains the MS2 mass spectrum of Sulfamethoxypyridazine with the InChIkey VLYWMPOKSSWJAL-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C11H12N4O3S/c1-18-11-7-6-10(13-14-11)15-19(16,17)9-4-2-8(12)3-5-9/h2-7H,12H2,1H3,(H,13,15)
SMILES COc1ccc(nn1)NS(=O)(=O)c2ccc(cc2)N
InChI Key VLYWMPOKSSWJAL-UHFFFAOYSA-N
Molecular Formula C11H12N4O3S
Exact Mass 280.063 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU101503
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T08:52:37.651469
MetadataModified 2025-02-08T19:03:01.827104
MetadataPublished 2015-09-22
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL268869 ChEMBL
102516 ChEBI
J9.115D Nikkaji
2515 DrugCentral
HY-B1387 MedChemExpress
DTXSID5023611 EPA CompTox Dashboard
SULFAMETHOXYPYRIDAZINE rxnorm
SLFNMF CCDC
HMDB0258575 Human Metabolome Database
DB13773 DrugBank
ZINC000000049141 ZINC
11268 Brenda
CB1107025 ChemicalBook
MCULE-1902045342 Mcule
SCHEMBL93617 SureChEMBL
5330 PubChem
PD001487 ProbesDrugs
T034E4NS2Z FDA SRS
LSM-5204 LINCS
80-35-3 ACToR
14872997 PubChem: Thomson Pharma
631768 eMolecules
The data in this table is sourced from UniChem at EBI.