5-HETE
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT000177
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT000177 contains the MS2 mass spectrum of 5-HETE with the InChIkey KGIJOOYOSFUGPC-JGKLHWIESA-N.
Source: 5-HETE
Chemical Info
| InChI | InChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19(21)17-15-18-20(22)23/h6-7,9-10,12-14,16,19,21H,2-5,8,11,15,17-18H2,1H3,(H,22,23)/b7-6-,10-9-,13-12-,16-14+/t19-/m1/s1 |
|---|---|
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C=C\[C@H](CCCC(=O)O)O |
| InChI Key | KGIJOOYOSFUGPC-JGKLHWIESA-N |
| Molecular Formula | C20H32O3 |
| Exact Mass | 320.235 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 | 7bafa437-0425-4293-a4ce-aa8aaa9bf920 |
| Package id | msbnk-chubu_univ-ut000177 |
| Resource type | HTML |
| State | active |