Phosphatidylcholine alkyl 18:1-16:0
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT003155
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT003155 contains the MS3 mass spectrum of Phosphatidylcholine alkyl 18:1-16:0 with the InChIkey ITFYCOXGRQISEW-HYOGKJQXSA-N.
Chemical Info
| InChI | InChI=1S/C42H84NO7P/c1-6-8-10-12-14-16-18-20-21-22-24-26-28-30-32-34-37-47-39-41(40-49-51(45,46)48-38-36-43(3,4)5)50-42(44)35-33-31-29-27-25-23-19-17-15-13-11-9-7-2/h28,30,41H,6-27,29,31-40H2,1-5H3/b30-28- |
|---|---|
| SMILES | C[N+1](C)(C)CCOP([O-1])(=O)OCC(OC(=O)CCCCCCCCCCCCCCC)COCCCC=CCCCCCCCCCCCCC |
| InChI Key | ITFYCOXGRQISEW-HYOGKJQXSA-N |
| Molecular Formula | C42H84NO7P |
| Exact Mass | 745.599 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 | b9360f94-1433-4fdc-bc55-e3ffb9ff551b |
| Package id | msbnk-chubu_univ-ut003155 |
| Resource type | HTML |
| State | active |