2-2-4-Trimethyl-1-3-pentanediol-diisobutyrate
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01074907
Dataset description:
This MassBank record with Accession MSBNK-Eawag-EQ01074907 contains the MS2 mass spectrum of 2-2-4-Trimethyl-1-3-pentanediol-diisobutyrate with the InChIkey OMVSWZDEEGIJJI-UHFFFAOYSA-N.
Chemical Info
| InChI | InChI=1S/C16H30O4/c1-10(2)13(20-15(18)12(5)6)16(7,8)9-19-14(17)11(3)4/h10-13H,9H2,1-8H3 |
|---|---|
| SMILES | CC(C)C(C(C)(C)COC(=O)C(C)C)OC(=O)C(C)C |
| InChI Key | OMVSWZDEEGIJJI-UHFFFAOYSA-N |
| Molecular Formula | C16H30O4 |
| Exact Mass | 286.214 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 | a8c97a2e-3376-4713-b280-5c955713f932 |
| Package id | msbnk-eawag-eq01074907 |
| Resource type | HTML |
| State | active |