Dataset

N-?-Benzoyl-L-arginine; LC-APCI-QTOF; MS; POSITIVE

This MassBank record with Accession MSBNK-Washington_State_Univ-BML81837 contains the MS mass spectrum of N-?-Benzoyl-L-arginine with the InChIkey RSYYQCDERUOEFI-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C13H18N4O3/c14-13(15)16-8-4-7-10(12(19)20)17-11(18)9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2,(H,17,18)(H,19,20)(H4,14,15,16)
SMILES C1=CC=C(C=C1)C(=O)NC(CCCN=C(N)N)C(=O)O
InChI Key RSYYQCDERUOEFI-UHFFFAOYSA-N
Molecular Formula C13H18N4O3
Exact Mass 278.138 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-BML81837
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • 2-benzamido-5-(diaminomethylideneamino)pentanoic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL180240 ChEMBL
    HMDB0244698 Human Metabolome Database
    CB4329084 ChemicalBook
    242206 Brenda
    25201197 PubChem
    14824376 PubChem: Thomson Pharma
    SCHEMBL188589 SureChEMBL
    722441 eMolecules
    21329 Brenda
    134347 Brenda
    112976 Brenda
    100059 Brenda
    141616 Brenda
    18166 Brenda
    9108 Brenda
    81731 Brenda
    21321 Brenda
    52005 Brenda
    92415 Brenda
    J3.516.971G Nikkaji
    48850 Brenda
    30223 Brenda
    MCULE-7304248580 Mcule
    273355 PubChem
    The data in this table is sourced from UniChem at EBI.