Dataset

L-Carnosine, beta-Ala-His, L-Ignotine, beta-Alanyl-L-histidine

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS097803 contains the MS2 mass spectrum of L-Carnosine, beta-Ala-His, L-Ignotine, beta-Alanyl-L-histidine with the InChIkey CQOVPNPJLQNMDC-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C9H14N4O3/c10-2-1-8(14)13-7(9(15)16)3-6-4-11-5-12-6/h4-5,7H,1-3,10H2,(H,11,12)(H,13,14)(H,15,16)
SMILES C1=C(NC=N1)CC(C(=O)O)NC(=O)CCN
InChI Key CQOVPNPJLQNMDC-UHFFFAOYSA-N
Molecular Formula C9H14N4O3
Exact Mass 226.236 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-PS097803
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:24:09.836572
MetadataModified 2025-02-09T19:06:09.545729
MetadataPublished 2009-02-09
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL18545 ChEMBL
HMDB0256117 Human Metabolome Database
CB6135333 ChemicalBook
5249653 PubChem
MCULE-9115243868 Mcule
9369 PubChem
14798058 PubChem: Thomson Pharma
SCHEMBL33768 SureChEMBL
PD063194 ProbesDrugs
26402308 eMolecules
29549641 eMolecules
The data in this table is sourced from UniChem at EBI.