N-Acetyl mesalazine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU272501
Dataset description:
This MassBank record with Accession MSBNK-Athens_Univ-AU272501 contains the MS2 mass spectrum of N-Acetyl mesalazine with the InChIkey GEFDRROBUCULOD-UHFFFAOYSA-N.
Source: N-Acetyl mesalazine
Chemical Info
| InChI | InChI=1S/C9H9NO4/c1-5(11)10-6-2-3-8(12)7(4-6)9(13)14/h2-4,12H,1H3,(H,10,11)(H,13,14) |
|---|---|
| SMILES | CC(=O)NC1=CC=C(O)C(=C1)C(O)=O |
| InChI Key | GEFDRROBUCULOD-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO4 |
| Exact Mass | 195.053 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | January 11, 2024 |
| Metadata last updated | January 11, 2024 |
| Created | January 11, 2024 |
| Format | HTML |
| License | Attribution 4.0 International (CC BY 4.0) |
| Id | da5d2426-5721-4aeb-9776-0ffff01755fd |
| Package id | msbnk-athens_univ-au272501 |
| Resource type | HTML |
| State | active |