Dataset

N-Methylpregabalin

This MassBank record with Accession MSBNK-Eawag-EQ01152008 contains the MS2 mass spectrum of N-Methylpregabalin with the InChIkey MADUVMLGQASXOK-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C9H19NO2/c1-7(2)4-8(6-10-3)5-9(11)12/h7-8,10H,4-6H2,1-3H3,(H,11,12)
SMILES CC(C)CC(CC(=O)O)CNC
InChI Key MADUVMLGQASXOK-UHFFFAOYSA-N
Molecular Formula C9H19NO2
Exact Mass 173.142 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-Eawag-EQ01152008
Version
Author
Maintainer
Language
MetadataCreated 2025-02-09T10:00:24.488689
MetadataModified 2025-02-09T10:00:24.696550
MetadataPublished 2024-05-08
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
SCHEMBL8011226 SureChEMBL
74603440 PubChem
The data in this table is sourced from UniChem at EBI.