Dataset

Feruloyl agmatine (isomer of 1607)

This MassBank record with Accession MSBNK-RIKEN-PR311014 contains the MS2 mass spectrum of Feruloyl agmatine (isomer of 1607) with the InChIkey UBMDAKWARMURDL-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H22N4O3/c1-22-13-10-11(4-6-12(13)20)5-7-14(21)18-8-2-3-9-19-15(16)17/h4-7,10,20H,2-3,8-9H2,1H3,(H,18,21)(H4,16,17,19)
SMILES O=C(C=CC1=CC=C(O)C(OC)=C1)NCCCCNC(=N)N
InChI Key UBMDAKWARMURDL-UHFFFAOYSA-N
Molecular Formula C15H22N4O3
Exact Mass 306.366 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-PR311014
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T20:44:17.125840
MetadataModified 2024-01-11T20:44:17.327767
MetadataPublished 2019-03-28
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
54344714 PubChem
86091 ChEBI
The data in this table is sourced from UniChem at EBI.