Dataset

3-Methyl-L-histidine, N-pros-Methyl-L-histidine, 3-(1-Methylimidazol-5-yl)-L-alanine, 3-Me-His

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS096702 contains the MS2 mass spectrum of 3-Methyl-L-histidine, N-pros-Methyl-L-histidine, 3-(1-Methylimidazol-5-yl)-L-alanine, 3-Me-His with the InChIkey JDHILDINMRGULE-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C7H11N3O2/c1-10-4-9-3-5(10)2-6(8)7(11)12/h3-4,6H,2,8H2,1H3,(H,11,12)
SMILES CN1C=NC=C1CC(C(=O)O)N
InChI Key JDHILDINMRGULE-UHFFFAOYSA-N
Molecular Formula C7H11N3O2
Exact Mass 169.184 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-PS096702
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:07:30.693849
MetadataModified 2024-01-11T21:07:30.854711
MetadataPublished 2009-02-09
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
SCHEMBL28559 SureChEMBL
MCULE-8928603063 Mcule
MTBLC70959 Metabolights
MTBLC133609 Metabolights
133609 ChEBI
70959 ChEBI
78432242 PubChem
PD099651 ProbesDrugs
60023515 NMRShiftDB
565965 PubChem
29549738 eMolecules
The data in this table is sourced from UniChem at EBI.