Methylecgonine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01153004
Dataset description:
This MassBank record with Accession MSBNK-Eawag-EQ01153004 contains the MS2 mass spectrum of Methylecgonine with the InChIkey QIQNNBXHAYSQRY-UHFFFAOYSA-N.
Source: Methylecgonine
Chemical Info
| InChI | InChI=1S/C10H17NO3/c1-11-6-3-4-7(11)9(8(12)5-6)10(13)14-2/h6-9,12H,3-5H2,1-2H3 |
|---|---|
| SMILES | CN1C2CCC1C(C(C2)O)C(=O)OC |
| InChI Key | QIQNNBXHAYSQRY-UHFFFAOYSA-N |
| Molecular Formula | C10H17NO3 |
| Exact Mass | 199.121 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | February 9, 2025 |
| Metadata last updated | February 9, 2025 |
| Created | February 9, 2025 |
| Format | HTML |
| License | Attribution-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | 2e3476fc-5b4b-40f5-b1e6-c0f61c0fa49b |
| Package id | msbnk-eawag-eq01153004 |
| Resource type | HTML |
| State | active |