9-HpOTrE
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT000268
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT000268 contains the MS2 mass spectrum of 9-HpOTrE with the InChIkey RWKJTIHNYSIIHW-WYVZXCPWSA-N.
Source: 9-HpOTrE
Chemical Info
| InChI | InChI=1S/C18H30O4/c1-2-3-4-5-6-8-11-14-17(22-21)15-12-9-7-10-13-16-18(19)20/h3-4,6,8,11,14,17,21H,2,5,7,9-10,12-13,15-16H2,1H3,(H,19,20)/b4-3-,8-6?,14-11+ |
|---|---|
| SMILES | CCC=CCC=CC=CC(OO)CCCCCCCC(O)=O |
| InChI Key | RWKJTIHNYSIIHW-WYVZXCPWSA-N |
| Molecular Formula | C18H30O4 |
| Exact Mass | 310.214 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 | dc82dbf3-046d-498f-87c5-7a743950a1cf |
| Package id | msbnk-chubu_univ-ut000268 |
| Resource type | HTML |
| State | active |