Tripalmitin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_N105116_CC60
Dataset description:
This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_N105116_CC60 contains the MS2 mass spectrum of Tripalmitin with the InChIkey PVNIQBQSYATKKL-UHFFFAOYSA-N.
Source: Tripalmitin
Chemical Info
| InChI | InChI=1S/C51H98O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-49(52)55-46-48(57-51(54)45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)47-56-50(53)44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h48H,4-47H2,1-3H3 |
|---|---|
| SMILES | [H]C(COC(=O)CCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC |
| InChI Key | PVNIQBQSYATKKL-UHFFFAOYSA-N |
| Molecular Formula | C51H98O6 |
| Exact Mass | 806.736 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 4.0 International (CC BY 4.0) |
| Id | a42d9582-35f1-4683-92f8-ff6131031064 |
| Package id | msbnk-antwerp_univ-metox_n105116_cc60 |
| Resource type | HTML |
| State | active |