5-HEPE
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT000169
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT000169 contains the MS2 mass spectrum of 5-HEPE with the InChIkey FTAGQROYQYQRHF-GHWNLOBHSA-N.
Source: 5-HEPE
Chemical Info
| InChI | InChI=1S/C20H30O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19(21)17-15-18-20(22)23/h3-4,6-7,9-10,12-14,16,19,21H,2,5,8,11,15,17-18H2,1H3,(H,22,23)/b4-3-,7-6-,10-9-,13-12-,16-14+/t19-/m1/s1 |
|---|---|
| SMILES | CCC=CCC=CCC=CCC=CC=CC(O)CCCC(O)=O |
| InChI Key | FTAGQROYQYQRHF-GHWNLOBHSA-N |
| Molecular Formula | C20H30O3 |
| Exact Mass | 318.219 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-ShareAlike 4.0 International (CC BY-NC-SA 4.0) |
| Id | 59e37986-3b53-45a8-aec3-0b17e81d7644 |
| Package id | msbnk-chubu_univ-ut000169 |
| Resource type | HTML |
| State | active |