Phosphatidylcholine alkyl 16:0-18:1
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT002803
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT002803 contains the MS2 mass spectrum of Phosphatidylcholine alkyl 16:0-18:1 with the InChIkey KFLBTRVMABAQOU-YCNYHXFESA-N.
Chemical Info
| InChI | InChI=1S/C42H84NO7P/c1-6-8-10-12-14-16-18-20-22-23-25-27-29-31-33-35-42(44)50-41(40-49-51(45,46)48-38-36-43(3,4)5)39-47-37-34-32-30-28-26-24-21-19-17-15-13-11-9-7-2/h29,31,41H,6-28,30,32-40H2,1-5H3/b31-29- |
|---|---|
| SMILES | C[N+1](C)(C)CCOP(OCC(OC(=O)CCC=CCCCCCCCCCCCCC)COCCCCCCCCCCCCCCCC)([O-1])=O |
| InChI Key | KFLBTRVMABAQOU-YCNYHXFESA-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 | b334e942-55c6-4255-befe-0b3ba4339b62 |
| Package id | msbnk-chubu_univ-ut002803 |
| Resource type | HTML |
| State | active |