Mono-carboxy-isononyl phthalate
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-AN115731
Dataset description:
This MassBank record with Accession MSBNK-Antwerp_Univ-AN115731 contains the MS2 mass spectrum of Mono-carboxy-isononyl phthalate with the InChIkey IOWADRRGIUUGJH-UHFFFAOYSA-N.
Source: Mono-carboxy-isononyl phthalate
Chemical Info
| InChI | InChI=1S/C18H24O6/c1-13(9-5-3-2-4-6-12-16(19)20)24-18(23)15-11-8-7-10-14(15)17(21)22/h7-8,10-11,13H,2-6,9,12H2,1H3,(H,19,20)(H,21,22) |
|---|---|
| SMILES | CC(CCCCCCCC(=O)O)OC(=O)C1=CC=CC=C1C(=O)O |
| InChI Key | IOWADRRGIUUGJH-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 | f9f04ddb-562b-4c6c-b1a0-e404f4c9e266 |
| Package id | msbnk-antwerp_univ-an115731 |
| Resource type | HTML |
| State | active |