8-2-diPAP
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ00292351
Dataset description:
This MassBank record with Accession MSBNK-Eawag-EQ00292351 contains the MS2 mass spectrum of 8-2-diPAP with the InChIkey AFWOYEYXUDHGHF-UHFFFAOYSA-N.
Source: 8-2-diPAP
Chemical Info
| InChI | InChI=1S/C20H9F34O4P/c21-5(22,7(25,26)9(29,30)11(33,34)13(37,38)15(41,42)17(45,46)19(49,50)51)1-3-57-59(55,56)58-4-2-6(23,24)8(27,28)10(31,32)12(35,36)14(39,40)16(43,44)18(47,48)20(52,53)54/h1-4H2,(H,55,56) |
|---|---|
| SMILES | C(COP(=O)(O)OCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
| InChI Key | AFWOYEYXUDHGHF-UHFFFAOYSA-N |
| Molecular Formula | C20H9F34O4P |
| Exact Mass | 989.970 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | February 9, 2025 |
| Metadata last updated | February 9, 2025 |
| Created | February 9, 2025 |
| Format | HTML |
| License | Attribution-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | 2994bc5b-353b-4991-a093-ebf3777b1e32 |
| Package id | msbnk-eawag-eq00292351 |
| Resource type | HTML |
| State | active |