Dataset

N-Allyladenosine

This MassBank record with Accession MSBNK-Washington_State_Univ-BML01454 contains the MS2 mass spectrum of N-Allyladenosine with the InChIkey WTYYPLSFICPDGL-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C13H17N5O4/c1-2-3-14-11-8-12(16-5-15-11)18(6-17-8)13-10(21)9(20)7(4-19)22-13/h2,5-7,9-10,13,19-21H,1,3-4H2,(H,14,15,16)
SMILES C=CCNC1=NC=NC2=C1N=CN2C3C(C(C(O3)CO)O)O
InChI Key WTYYPLSFICPDGL-UHFFFAOYSA-N
Molecular Formula C13H17N5O4
Exact Mass 307.128 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-BML01454
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:25:38.546594
MetadataModified 2024-01-11T22:25:38.696239
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
1201918 eMolecules
CHEMBL46703 ChEMBL
97057 BindingDB
MCULE-3110776707 Mcule
15763-12-9 ACToR
264006 PubChem
The data in this table is sourced from UniChem at EBI.