Dataset

N-ACETYLASPARTATE

This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_P101206_FB57 contains the MS2 mass spectrum of N-ACETYLASPARTATE with the InChIkey OTCCIMWXFLJLIA-BYPYZUCNSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C6H9NO5/c1-3(8)7-4(6(11)12)2-5(9)10/h4H,2H2,1H3,(H,7,8)(H,9,10)(H,11,12)/t4-/m0/s1
SMILES CC(=O)N[C@@H](CC(O)=O)C(O)=O
InChI Key OTCCIMWXFLJLIA-BYPYZUCNSA-N
Molecular Formula C6H9NO5
Exact Mass 175.048 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_P101206_FB57
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:29:39.005263
MetadataModified 2024-01-11T09:29:39.179732
MetadataPublished 2021-12-23
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables