Emodin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000134
Dataset description:
This MassBank record with Accession MSBNK-AAFC-AC000134 contains the MS2 mass spectrum of Emodin with the InChIkey RHMXXJGYXNZAPX-UHFFFAOYSA-N.
Source: Emodin
Chemical Info
| InChI | InChI=1S/C15H10O5/c1-6-2-8-12(10(17)3-6)15(20)13-9(14(8)19)4-7(16)5-11(13)18/h2-5,16-18H,1H3 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)O)O)O |
| InChI Key | RHMXXJGYXNZAPX-UHFFFAOYSA-N |
| Molecular Formula | C15H10O5 |
| Exact Mass | 270.053 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-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | 1e5234ce-b32e-4bdf-897f-364bcd8e688a |
| Package id | msbnk-aafc-ac000134 |
| Resource type | HTML |
| State | active |