Dataset

R-3-Amino-5-(methylthio)pentanoic acid hydrochloride, L-beta-homomethionine-HCl

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS060901 contains the MS2 mass spectrum of R-3-Amino-5-(methylthio)pentanoic acid hydrochloride, L-beta-homomethionine-HCl with the InChIkey QWVNCDVONVDGDV-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C6H13NO2S/c1-10-3-2-5(7)4-6(8)9/h5H,2-4,7H2,1H3,(H,8,9)
SMILES CSCCC(CC(=O)O)N
InChI Key QWVNCDVONVDGDV-UHFFFAOYSA-N
Molecular Formula C6H13NO2S
Exact Mass 163.240 g/mol

Data and Resources

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-PS060901
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:08:06.021578
MetadataModified 2024-01-11T21:08:06.195490
MetadataPublished 2009-02-09
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
SCHEMBL1256549 SureChEMBL
CB5497805 ChemicalBook
532520 eMolecules
182723 ChEBI
DTXSID20399589 EPA CompTox Dashboard
4124656 PubChem
The data in this table is sourced from UniChem at EBI.