Dataset

3-(2-Naphthyl)-D-alanine

This MassBank record with Accession MSBNK-Washington_State_Univ-BML01685 contains the MS2 mass spectrum of 3-(2-Naphthyl)-D-alanine with the InChIkey JPZXHKDZASGCLU-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C13H13NO2/c14-12(13(15)16)8-9-5-6-10-3-1-2-4-11(10)7-9/h1-7,12H,8,14H2,(H,15,16)
SMILES C1=CC=C2C=C(C=CC2=C1)CC(C(=O)O)N
InChI Key JPZXHKDZASGCLU-UHFFFAOYSA-N
Molecular Formula C13H13NO2
Exact Mass 215.095 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-BML01685
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:25:53.793474
MetadataModified 2024-01-11T22:25:53.949104
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
14748983 PubChem: Thomson Pharma
14108-60-2 ACToR
PD043148 ProbesDrugs
SCHEMBL93304 SureChEMBL
250399 PubChem
CB9199835 ChemicalBook
DTXSID50290595 EPA CompTox Dashboard
MCULE-6903330528 Mcule
136452 Brenda
CHEMBL3272605 ChEMBL
J1.213.364B Nikkaji
592769 eMolecules
The data in this table is sourced from UniChem at EBI.