Mono(2-propyl-6-carboxyhexyl) phthalate
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-AN114325
Dataset description:
This MassBank record with Accession MSBNK-Antwerp_Univ-AN114325 contains the MS2 mass spectrum of Mono(2-propyl-6-carboxyhexyl) phthalate with the InChIkey DPQMLPCFIOCYFY-UHFFFAOYSA-N.
Chemical Info
| InChI | InChI=1S/C18H24O6/c1-2-7-13(8-3-6-11-16(19)20)12-24-18(23)15-10-5-4-9-14(15)17(21)22/h4-5,9-10,13H,2-3,6-8,11-12H2,1H3,(H,19,20)(H,21,22) |
|---|---|
| SMILES | CCCC(CCCCC(=O)O)COC(=O)c1ccccc1C(=O)O |
| InChI Key | DPQMLPCFIOCYFY-UHFFFAOYSA-N |
| Molecular Formula | C18H24O6 |
| Exact Mass | 336.157 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 | 197ff808-3281-498e-a6c0-132381a50411 |
| Package id | msbnk-antwerp_univ-an114325 |
| Resource type | HTML |
| State | active |