| SpectraBase Spectrum ID |
5XKq4ueI6Wu |
| Name |
Ethylecgonine AC |
| Classification |
Drug derivative |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
255.147058156 u |
| Formula |
C13H21NO4 |
| InChI |
InChI=1S/C13H21NO4/c1-4-17-13(16)12-10-6-5-9(14(10)3)7-11(12)18-8(2)15/h9-12H,4-7H2,1-3H3/t9-,10+,11-,12+/m0/s1 |
| InChIKey |
DRCOFQXWPKJAOS-WHOHXGKFSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
255.314 g/mol |
| Nominal Mass |
255 u |
| Quality |
994 |
| Retention Index |
2002 |
| SMILES |
[C@]1([C@](C[C@]2(N([C@@]1(CC2)[H])C)[H])(OC(=O)C)[H])(C(OCC)=O)[H] |
| SPLASH |
splash10-001m-9410000000-ace4d56ed566c9701758 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
ethyl 3-(acetyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_001362 |
