Urocanic acid
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML82313
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML82313 contains the MS mass spectrum of Urocanic acid with the InChIkey LOIYMIARKYCTBW-UHFFFAOYSA-N.
Source: Urocanic acid
Chemical Info
| InChI | InChI=1S/C6H6N2O2/c9-6(10)2-1-5-3-7-4-8-5/h1-4H,(H,7,8)(H,9,10) |
|---|---|
| SMILES | C1=C(NC=N1)C=CC(=O)O |
| InChI Key | LOIYMIARKYCTBW-UHFFFAOYSA-N |
| Molecular Formula | C6H6N2O2 |
| Exact Mass | 138.043 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-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | 58046837-fb00-4938-b102-544f7ab0c6c4 |
| Package id | msbnk-washington_state_univ-bml82313 |
| Resource type | HTML |
| State | active |