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Ethylecgonine AC
SpectraBase Compound ID CNbXoIk3mxl
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
Mol Weight 255.31 g/mol
Molecular Formula C13H21NO4
Exact Mass 255.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FAxJKgmLBY
Name Ethylecgonine AC
Classification Drug derivative
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-9300000000-f3f8010cc4afa8c176a5
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_033446