13-HOTrE(r)
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT000050
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT000050 contains the MS2 mass spectrum of 13-HOTrE(r) with the InChIkey HNBLUNXZQNJFRB-KYLWABQHSA-N.
Source: 13-HOTrE(r)
Chemical Info
| InChI | InChI=1S/C18H30O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h4,6-7,9,12,15,17,19H,2-3,5,8,10-11,13-14,16H2,1H3,(H,20,21)/b6-4-,9-7-,15-12+/t17-/m0/s1 |
|---|---|
| SMILES | CCCCCC(O)C=CC=CCC=CCCCCC(O)=O |
| InChI Key | HNBLUNXZQNJFRB-KYLWABQHSA-N |
| Molecular Formula | C18H30O3 |
| Exact Mass | 294.219 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 | a327c821-868e-4167-b0e1-5ed61a529df0 |
| Package id | msbnk-chubu_univ-ut000050 |
| Resource type | HTML |
| State | active |