Mono-2-(propyl-6-oxoheptyl)-phthalate
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-AN114226
Dataset description:
This MassBank record with Accession MSBNK-Antwerp_Univ-AN114226 contains the MS2 mass spectrum of Mono-2-(propyl-6-oxoheptyl)-phthalate with the InChIkey NSGSMZPMFOBAFF-UHFFFAOYSA-N.
Chemical Info
| InChI | InChI=1S/C18H24O5/c1-3-7-14(9-6-8-13(2)19)12-23-18(22)16-11-5-4-10-15(16)17(20)21/h4-5,10-11,14H,3,6-9,12H2,1-2H3,(H,20,21) |
|---|---|
| SMILES | CCCC(CCCC(C)=O)COC(=O)c1ccccc1C(=O)O |
| InChI Key | NSGSMZPMFOBAFF-UHFFFAOYSA-N |
| Molecular Formula | C18H24O5 |
| Exact Mass | 320.162 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 | 8f8b8c91-e4eb-4c3a-ba9f-28e833c7a687 |
| Package id | msbnk-antwerp_univ-an114226 |
| Resource type | HTML |
| State | active |