Dataset

L-beta-homolysine-2HCl, (3S)-3,7-diaminoheptanoic acid

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS060804 contains the MS2 mass spectrum of L-beta-homolysine-2HCl, (3S)-3,7-diaminoheptanoic acid with the InChIkey PJDINCOFOROBQW-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C7H16N2O2/c8-4-2-1-3-6(9)5-7(10)11/h6H,1-5,8-9H2,(H,10,11)
SMILES C(CCN)CC(CC(=O)O)N
InChI Key PJDINCOFOROBQW-UHFFFAOYSA-N
Molecular Formula C7H16N2O2
Exact Mass 160.217 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-PS060804
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:32:49.200981
MetadataModified 2025-02-09T19:06:10.760899
MetadataPublished 2009-02-09
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL5222920 ChEMBL
4695301 PubChem
181201 ChEBI
J1.845.936A Nikkaji
SCHEMBL284983 SureChEMBL
The data in this table is sourced from UniChem at EBI.