Diisodecyl phthalate
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-AN112612
Dataset description:
This MassBank record with Accession MSBNK-Antwerp_Univ-AN112612 contains the MS2 mass spectrum of Diisodecyl phthalate with the InChIkey ZVFDTKUVRCTHQE-UHFFFAOYSA-N.
Source: Diisodecyl phthalate
Chemical Info
| InChI | InChI=1S/C28H46O4/c1-23(2)17-11-7-5-9-15-21-31-27(29)25-19-13-14-20-26(25)28(30)32-22-16-10-6-8-12-18-24(3)4/h13-14,19-20,23-24H,5-12,15-18,21-22H2,1-4H3 |
|---|---|
| SMILES | CC(C)CCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC(C)C |
| InChI Key | ZVFDTKUVRCTHQE-UHFFFAOYSA-N |
| Molecular Formula | C28H46O4 |
| Exact Mass | 446.340 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 | 4b147591-b707-49bd-872b-603246f9fac6 |
| Package id | msbnk-antwerp_univ-an112612 |
| Resource type | HTML |
| State | active |