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URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PS012309
Dataset description:
This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS012309 contains the MS2 mass spectrum of all trans-3,7,11,15-Tetramethyl-2,6,10,14-hexadecatetraenyl pyrophosphate ammonium salt,...
Chemical Info
| InChI | InChI=1S/C20H36O7P2/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-26-29(24,25)27-28(21,22)23/h9,11,13,15H,6-8,10,12,14,16H2,1-5H3,(H,24,25)(H2,21,22,23) |
|---|---|
| SMILES | CC(=CCCC(=CCCC(=CCCC(=CCOP(=O)(O)OP(=O)(O)O)C)C)C)C |
| InChI Key | OINNEUNVOZHBOX-UHFFFAOYSA-N |
| Molecular Formula | C20H36O7P2 |
| Exact Mass | 450.453 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 4.0 International (CC BY-NC 4.0) |
| Id | 49cc5d06-827a-4f52-bee3-19d742d6eeda |
| Package id | msbnk-riken_respect-ps012309 |
| Resource type | HTML |
| State | active |