N-ACETYLASPARTATE
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_P101206_FB57
Dataset description:
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.
Source: 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 |
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Additional Information
Field | Value |
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Data last updated | January 11, 2024 |
Metadata last updated | January 11, 2024 |
Created | January 11, 2024 |
Format | HTML |
License | No License Provided |
Id | ebd75396-def5-43a7-bdd3-211a52216176 |
Package id | msbnk-antwerp_univ-metox_p101206_fb57 |
Resource type | HTML |
State | active |