Dataset

Phenyl-butyryl-glutamine

This MassBank record with Accession MSBNK-RIKEN-PR311145 contains the MS2 mass spectrum of Phenyl-butyryl-glutamine with the InChIkey XKQKXKRCMAJADR-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H20N2O4/c16-13(18)10-9-12(15(20)21)17-14(19)8-4-7-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H2,16,18)(H,17,19)(H,20,21)
SMILES O=C(O)C(NC(=O)CCCC1=CC=CC=C1)CCC(=O)N
InChI Key XKQKXKRCMAJADR-UHFFFAOYSA-N
Molecular Formula C15H20N2O4
Exact Mass 292.335 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR311145
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T20:34:16.309461
MetadataModified 2025-02-09T18:27:39.972138
MetadataPublished 2019-03-28
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
HMDB0011687 Human Metabolome Database
165896 ChEBI
9943917 PubChem
14918273 PubChem: Thomson Pharma
The data in this table is sourced from UniChem at EBI.