Bisphenol S
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-AN120833
Dataset description:
This MassBank record with Accession MSBNK-Antwerp_Univ-AN120833 contains the MS2 mass spectrum of Bisphenol S with the InChIkey VPWNQTHUCYMVMZ-UHFFFAOYSA-N.
Source: Bisphenol S
Chemical Info
| InChI | InChI=1S/C12H10O4S/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12/h1-8,13-14H |
|---|---|
| SMILES | C1=CC(=CC=C1O)S(=O)(=O)C2=CC=C(C=C2)O |
| InChI Key | VPWNQTHUCYMVMZ-UHFFFAOYSA-N |
| Molecular Formula | C12H10O4S |
| Exact Mass | 250.030 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 | No License Provided |
| Id | 5b808ec9-1faa-4d45-8f81-f8cbf757230e |
| Package id | msbnk-antwerp_univ-an120833 |
| Resource type | HTML |
| State | active |