| SpectraBase Spectrum ID |
9yUGoIMD6G2 |
| Name |
Cocaethylene |
| Alternate Name(s) |
Ethyl 3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H23NO4 |
| InChI |
InChI=1S/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3/t13-,14+,15?,16?/m1/s1 |
| InChIKey |
NMPOSNRHZIWLLL-QVOMUQBLSA-N |
| Molecular Weight |
317.385 g/mol |
| SMILES |
C1C[C@]2(C(C(C[C@@]1(N2C)[H])OC(=O)c1ccccc1)C(OCC)=O)[H] |
| SPLASH |
splash10-001j-9300000000-dffcaa8bf433bb0ea3f4 |
| Source of Spectrum |
SWG-33-1640-0 |
| Wiley ID |
1809292 |
