Phenylethanol + Hex-Pen
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR309419
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR309419 contains the MS2 mass spectrum of Phenylethanol + Hex-Pen with the InChIkey GZSQKOFXMZDKPV-UHFFFAOYSA-N.
Source: Phenylethanol + Hex-Pen
Chemical Info
| InChI | InChI=1S/C19H28O10/c20-9-19(25)10-28-18(16(19)24)27-8-12-13(21)14(22)15(23)17(29-12)26-7-6-11-4-2-1-3-5-11/h1-5,12-18,20-25H,6-10H2 |
|---|---|
| SMILES | OCC3(O)(COC(OCC2OC(OCCC1=CC=CC=C1)C(O)C(O)C2(O))C3(O)) |
| InChI Key | GZSQKOFXMZDKPV-UHFFFAOYSA-N |
| Molecular Formula | C19H28O10 |
| Exact Mass | 416.423 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-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0) |
| Id | 20d00e87-f1a7-4466-9263-760a314ce9ef |
| Package id | msbnk-riken-pr309419 |
| Resource type | HTML |
| State | active |