Ecgonine-methyl-ester (EME)
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU161804
Dataset description:
This MassBank record with Accession MSBNK-Athens_Univ-AU161804 contains the MS2 mass spectrum of Ecgonine-methyl-ester (EME) with the InChIkey QIQNNBXHAYSQRY-ABIFROTESA-N.
Source: Ecgonine-methyl-ester (EME)
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/t6?,7?,8-,9+/m0/s1 |
|---|---|
| SMILES | COC(=O)[C@@H]1C2CCC(C[C@@H]1O)N2C |
| InChI Key | QIQNNBXHAYSQRY-ABIFROTESA-N |
| Molecular Formula | C10H17NO3 |
| Exact Mass | 199.121 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 | 566367fc-f0b6-4d3e-86f7-8f6e30da252f |
| Package id | msbnk-athens_univ-au161804 |
| Resource type | HTML |
| State | active |