Mono-iso-butyl phthalate
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-AN114728
Dataset description:
This MassBank record with Accession MSBNK-Antwerp_Univ-AN114728 contains the MS2 mass spectrum of Mono-iso-butyl phthalate with the InChIkey RZJSUWQGFCHNFS-UHFFFAOYSA-N.
Source: Mono-iso-butyl phthalate
Chemical Info
| InChI | InChI=1S/C12H14O4/c1-8(2)7-16-12(15)10-6-4-3-5-9(10)11(13)14/h3-6,8H,7H2,1-2H3,(H,13,14) |
|---|---|
| SMILES | CC(C)COC(=O)C1=CC=CC=C1C(=O)O |
| InChI Key | RZJSUWQGFCHNFS-UHFFFAOYSA-N |
| Molecular Formula | C12H14O4 |
| Exact Mass | 222.089 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 | ad4b6dc1-e600-4ecb-b524-0c108ea69cb5 |
| Package id | msbnk-antwerp_univ-an114728 |
| Resource type | HTML |
| State | active |