17-HDoHE
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT000132
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT000132 contains the MS2 mass spectrum of 17-HDoHE with the InChIkey SWTYBBUBEPPYCX-BQRHHIOESA-N.
Source: 17-HDoHE
Chemical Info
| InChI | InChI=1S/C22H32O3/c1-2-3-15-18-21(23)19-16-13-11-9-7-5-4-6-8-10-12-14-17-20-22(24)25/h3,5-8,11-16,19,21,23H,2,4,9-10,17-18,20H2,1H3,(H,24,25)/b7-5-,8-6-,13-11-,14-12-,15-3+,19-16+ |
|---|---|
| SMILES | CCC=CCC(O)C=CC=CCC=CCC=CCC=CCCC(O)=O |
| InChI Key | SWTYBBUBEPPYCX-BQRHHIOESA-N |
| Molecular Formula | C22H32O3 |
| Exact Mass | 344.235 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 | 15d11794-0997-4748-9dcf-6e79764e5882 |
| Package id | msbnk-chubu_univ-ut000132 |
| Resource type | HTML |
| State | active |