Niacin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fiocruz-FIO00518
Dataset description:
This MassBank record with Accession MSBNK-Fiocruz-FIO00518 contains the MS2 mass spectrum of Niacin with the InChIkey PVNIIMVLHYAWGP-UHFFFAOYSA-N.
Source: Niacin
Chemical Info
| InChI | InChI=1S/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9) |
|---|---|
| SMILES | OC(=O)c(c1)cncc1 |
| InChI Key | PVNIIMVLHYAWGP-UHFFFAOYSA-N |
| Molecular Formula | C6H5NO2 |
| Exact Mass | 123.032 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-NonCommercial 4.0 International (CC BY-NC 4.0) |
| Id | b22759a2-e1b5-48ad-8290-c14406a81d04 |
| Package id | msbnk-fiocruz-fio00518 |
| Resource type | HTML |
| State | active |