Dataset

N-?-Benzoyl-L-arginine

This MassBank record with Accession MSBNK-Washington_State_Univ-BML81835 contains the MS mass spectrum of N-?-Benzoyl-L-arginine with the InChIkey RSYYQCDERUOEFI-UHFFFAOYSA-N.

Chemical Info

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

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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-BML81835
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T22:27:07.522077
MetadataModified	2024-01-11T22:27:07.677233
MetadataPublished	2016-01-19

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
CHEMBL180240	ChEMBL
722441	eMolecules
25201197	PubChem
14824376	PubChem: Thomson Pharma
SCHEMBL188589	SureChEMBL
HMDB0244698	Human Metabolome Database
MCULE-7304248580	Mcule
273355	PubChem
242206	Brenda
CB4329084	ChemicalBook
52005	Brenda
21321	Brenda
141616	Brenda
81731	Brenda
92415	Brenda
J3.516.971G	Nikkaji
9108	Brenda
48850	Brenda
21329	Brenda
30223	Brenda
112976	Brenda
18166	Brenda
134347	Brenda
100059	Brenda
The data in this table is sourced from UniChem at EBI.