Dataset

2-Aminoethylsulfinic Acid, 2-Aminoethanesulfinic acid, Hypotaurine

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS025103 contains the MS2 mass spectrum of 2-Aminoethylsulfinic Acid, 2-Aminoethanesulfinic acid, Hypotaurine with the InChIkey VVIUBCNYACGLLV-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C2H7NO2S/c3-1-2-6(4)5/h1-3H2,(H,4,5)
SMILES	C(CS(=O)O)N
InChI Key	VVIUBCNYACGLLV-UHFFFAOYSA-N
Molecular Formula	C2H7NO2S
Exact Mass	109.148 g/mol

Data and Resources

2-Aminoethylsulfinic Acid,...HTML
Explore
- More information
- Go to resource

Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-nc/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PS025103
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T21:14:48.552100
MetadataModified	2025-02-09T19:22:40.793889
MetadataPublished	2009-02-09

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
J11.604A	Nikkaji
5161	Brenda
HY-100803	MedChemExpress
DTXSID8075380	EPA CompTox Dashboard
5L08GE4332	FDA SRS
CB3465040	ChemicalBook
CHEMBL1256480	ChEMBL
57853	ChEBI
16668	ChEBI
C00519	KEGG Ligand
538970	eMolecules
300-84-5	ACToR
hyptaur	Recon
15437093	PubChem: Thomson Pharma
PD015114	ProbesDrugs
25244088	PubChem
107812	PubChem
60020603	NMRShiftDB
SCHEMBL154548	SureChEMBL
MTBLC16668	Metabolights
MTBLC57853	Metabolights
HMDB0000965	Human Metabolome Database
214494	Brenda
ZINC000003995571	ZINC
57853	Rhea
The data in this table is sourced from UniChem at EBI.