Dataset
N-ACETYLASPARTATE
Chemical Info
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 |
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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 |
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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 |
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Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |