Dataset

Histidylserine

This MassBank record with Accession MSBNK-Washington_State_Univ-BML01508 contains the MS2 mass spectrum of Histidylserine with the InChIkey KRBMQYPTDYSENE-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C9H14N4O4/c10-6(1-5-2-11-4-12-5)8(15)13-7(3-14)9(16)17/h2,4,6-7,14H,1,3,10H2,(H,11,12)(H,13,15)(H,16,17)
SMILES C1=C(NC=N1)CC(C(=O)NC(CO)C(=O)O)N
InChI Key KRBMQYPTDYSENE-UHFFFAOYSA-N
Molecular Formula C9H14N4O4
Exact Mass 242.102 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML01508
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:23:27.977226
MetadataModified 2024-01-11T22:23:28.136049
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
7582993 eMolecules
539068 eMolecules
435727 PubChem
SCHEMBL1230293 SureChEMBL
WADXIJ CCDC
MCULE-8589663615 Mcule
DTXSID80331147 EPA CompTox Dashboard
15196475 PubChem: Thomson Pharma
21438-60-8 ACToR
16412189 PubChem: Thomson Pharma
The data in this table is sourced from UniChem at EBI.