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Cocaine MS2
SpectraBase Compound ID LwlAEVVA9Po
InChI InChI=1S/C17H21NO4/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3/t12-,13+,14-,15+/m1/s1
InChIKey ZPUCINDJVBIVPJ-UHFFFAOYSA-N
Mol Weight 303.36 g/mol
Molecular Formula C17H21NO4
Exact Mass 303.147058 g/mol
Enantiomer InChIKey ZPUCINDJVBIVPJ-LJISPDSOSA-N
Copyright Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum Maurer/Meyer/Helfer/Weber c/o Saarland University Homburg/Saar
Technique HCD
Copyright Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Technique ITMS
Copyright Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Technique ITMS
Copyright Copyright © 2023-2025 Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Copyright Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Copyright Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Copyright Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum SRH-2022-2772-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum CAY-2023-1336-0
Catalog Number 16186
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum A-2-655-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum SWG-33-3670-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum W-0-1056-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum NW-1071-0-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum UM-0-3-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum CD-130-0-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum JZ-1992-5503-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum JH-1982-193-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum JZ-1992-5467-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum JZ-1992-3142-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum JZ-1992-4597-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum JZ-1992-170-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum JZ-1992-2393-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum KO-16-264-2
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum JZ-1992-1143-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum JZ-1992-3290-0
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Solvent CDCl3
  • Cocaine-M (benzoylecgonine) ME MS2
  • 3b-Hydroxy-1aH,5aH-tropane-2b-carboxylic acid, methyl ester benzoate
  • Cocaine @
  • Cocaine
  • Pseudococaine
  • Pseudoallococaine
  • Kokain
  • Benzoylmethylecgonine
  • 1.alpha.H,5.alpha.H-Tropane-2.beta.-carboxylic acid, 3.beta.-hydroxy-, methyl ester, benzoate (ester)
  • L-Cocain
  • Coke
  • Girl
  • Leaf
  • Cecil
  • Cocaine, L-
  • Kokan
  • Burese
  • Caviar
  • Cholly
  • Cocain
  • Corine
  • Freeze
  • Heaven
  • Trails
  • Badrock
  • Bazooka
  • Bernice
  • Bernies
  • Cabello
  • Charlie
  • Cocaina
  • Kibbles N' bits
  • Blizzard
  • Cocktail
  • Delcaine
  • Goofball
  • Kokayeen
  • Stardust
  • 1-Cocaine
  • l-Cocaine
  • Gold dust
  • Isococain
  • Moonrocks
  • (1R,2R,3S,5S)-2-Methoxycarbonyltropan-3-yl benzoate
  • C'' carrie
  • Green gold
  • Happy dust
  • Isococaine
  • Neurocaine
  • Nose candy
  • Prime time
  • Sleighride
  • Allococaine
  • (-)-Cocaine
  • (R)-cocaine
  • Dama blanca
  • Dextrocaine
  • Erytroxylin
  • Sweet stuff
  • Depsococaine
  • Eritroxilina
  • Florida snow
  • Happy powder
  • Happy trails
  • Snow (birds)
  • D-phi-cocaine
  • Bouncing powder
  • Chicken scratch
  • D-pseudococaine
  • Allopseudococaine
  • Cocaine free base
  • (R)-pseudococaine
  • Pseudococaine, (+)
  • White girl or lady
  • 8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(benzoyloxy)-8-methyl-, methyl ester, (1R,2S,3S,5S)-
  • Benzoylethylecgonine
  • Star-spangled powder
  • Methyl benzoylecgonine
  • 8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(benzoyloxy)-8-methyl-, methyl ester, (2R,3S)-
  • Methyl 3-.beta.-hydroxy-1-.alpha.-H,5-.alpha.-H-tropane-2-.beta.-carboxylate benzoate
  • 2-Methyl-3.beta.-hydroxy-1.alpha.H,5.alpha.H-tropane-2.beta.-carboxylate benzoate (ester)
  • Methyl 3.beta.-hydroxy-1.alpha.H,5.alpha.H-tropane-2.beta.-carboxylate benzoate (ester)
  • Ecgonine, methyl ester, benzoate
  • 1-.alpha.-H,5-.alpha.-H-Tropane-2-.beta.-carboxylic acid, 3-.beta.-hydroxy-, methyl ester, benzoate
  • Ecgonine, methyl ester, benzoate (ester)
  • 8-Azabicyclo(3.2.1)octane-2-carboxylic acid, 3-(benzoyloxy)-8-methyl-, methyl ester, (1R-(exo,exo))-
  • [1R-(2-Endo-3-exo)]-3-(benzolyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid methyl ester
  • 3-Tropanylbenzoate-2-carboxylic acid methyl ester
  • 8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(benzoyloxy)-8-methyl-, methyl ester, [1R-(2-endo,3-exo)]-
  • 3-Benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester
  • 3.beta.-Hydroxy-2.beta.-tropanecarboxylic acid methyl ester, benzoate
  • Methyl 3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate
  • Methyl 3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate
  • Methyl 8-methyl-3-(phenylcarbonyloxy)-8-azabicyclo[3.2.1]octane-4-carboxylate
  • 2-.beta.-Tropanecarboxylic acid, 3-.beta.-hydroxy-, methyl ester, benzoate
  • 2.beta.-Tropanecarboxylic acid, 3.beta.-hydroxy-, methyl ester, benzoate (ester)
  • 3-(benzoyloxy)-8-methyl-8-azabicyclo-(3.2.1)octane-2-carboxylic acid methyl ether
  • BLAST
  • CANDY
  • FLAKE
  • SNORT
  • BLOW
  • COCA
  • COLA
  • FLEX
  • HELL
  • LADY
  • LINE
  • ROCK
  • SNOW
  • TOKE
  • TOOT
  • YEYO
  • FOO FOO
  • PIMP'S DRUG
  • G-ROCK
  • HSDB 6469
  • DEA NO. 9041
  • EINECS 200-032-7
  • beta-Cocain
  • Erythroxylin
  • Methyl (1S,3S,4R,5R)-3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate
  • Benzoyl-methyl-ecgonin
  • Cocaine-M (benzoylecgonine) ME
  • Methyl (1R,2R,3S,5S)-3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate

This compound is available in the following databases:

Maurer/Wissenbach/Weber LC-MSn Library of Drugs, Poisons, and Their Metabolites, 2nd Edition

Author: Hans H. Maurer, Dirk K. Wissenbach, Armin A. Weber

The Maurer/Wissenbach/Weber LC-MSn Library of Drugs, Poisons, and Their Metabolites provides a proven metabolite-based LCMSn screening method and MS2 and MS3 spectra of parent compounds and their metabolites, making it one of the only LC-MSn screening libraries that focuses on metabolite spectra. Learn more.

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