Retrorsine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR310600
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR310600 contains the MS2 mass spectrum of Retrorsine with the InChIkey BCJMNZRQJAVDLD-UHFFFAOYSA-N.
Source: Retrorsine
Chemical Info
| InChI | InChI=1S/C18H25NO6/c1-3-12-8-11(2)18(23,10-20)17(22)24-9-13-4-6-19-7-5-14(15(13)19)25-16(12)21/h3-4,11,14-15,20,23H,5-10H2,1-2H3 |
|---|---|
| SMILES | CC=C1CC(C)C(O)(CO)C(=O)OCC2=CCN3CCC(OC1=O)C23 |
| InChI Key | BCJMNZRQJAVDLD-UHFFFAOYSA-N |
| Molecular Formula | C18H25NO6 |
| Exact Mass | 351.399 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 | 43f3e7d7-96ad-4bf5-918d-01dd4159d053 |
| Package id | msbnk-riken-pr310600 |
| Resource type | HTML |
| State | active |