Hippuric acid
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_P100101_FB57
Dataset description:
This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_P100101_FB57 contains the MS2 mass spectrum of Hippuric acid with the InChIkey QIAFMBKCNZACKA-UHFFFAOYSA-N.
Source: Hippuric acid
Chemical Info
| InChI | InChI=1S/C9H9NO3/c11-8(12)6-10-9(13)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,13)(H,11,12) |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NCC(=O)O |
| InChI Key | QIAFMBKCNZACKA-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO3 |
| Exact Mass | 179.058 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 | No License Provided |
| Id | bbdbe383-d375-4ef4-b2fe-41e3e3f7b120 |
| Package id | msbnk-antwerp_univ-metox_p100101_fb57 |
| Resource type | HTML |
| State | active |