Cotinine
Compound with spectra: 4 NMR, 2 FTIR, and 9 MS (GC)
| SpectraBase Compound ID | BjO3PaODPcS |
|---|---|
| InChI | InChI=1S/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3 |
| InChIKey | UIKROCXWUNQSPJ-UHFFFAOYSA-N |
| Mol Weight | 176.22 g/mol |
| Molecular Formula | C10H12N2O |
| Exact Mass | 176.094963 g/mol |
| Copyright | Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved. |
|---|---|
| Source of Spectrum | Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences |
| Copyright | Copyright © 2023-2024 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 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
|---|---|
| Source of Spectrum | DigiLab GmbH (C) 2024 |
| Technique | GC/MS |
| Copyright | Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
|---|---|
| Source of Spectrum | DigiLab GmbH (C) 2024 |
| Technique | GC/MS |
| Copyright | Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
|---|---|
| Source of Spectrum | DigiLab GmbH (C) 2024 |
| Technique | GC/MS |
| Copyright | Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
|---|---|
| Source of Spectrum | DigiLab GmbH (C) 2024 |
| Technique | GC/MS |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | APC-317-25-1b |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | SRH-2022-3493-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | CAY-2024-2368-0 |
| Catalog Number | 40199 |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Alltech Associates, Inc., Grace Davison Discovery Sciences |
| Source of Spectrum | Forensic Spectral Research |
| Catalog Number | 01419 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | T. Nishida, A. Pilotti, C. R. Enzell Org. Magn. Resonance 13, 434(1980) |
| Solvent | Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Varian XL-100 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | Unknown |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Catalog Number | 284718 |
- L-Cotinine
- 2-Pyrrolidinone 1-methyl-5-(3-pyridinyl)- (S)
- UIKROCXWUNQSPJ-UHFFFAOYSA-N
- 1-Methyl-5-(3-pyridyl)-2-pyrrolidinone
- 2-PYRROLIDINONE, 1-METHYL- 5-/3-PYRIDYL/-,
- Nicotine-M (cotinine) @
- 3-cotinine
- (-)-Cotinine
- 1-Methyl-5-pyridin-3-yl-pyrrolidin-2-one
- S(-)-1-Methyl-5-(3-pyridyl)-2-pyrrolidone
- (S)-1-Methyl-5-(3-pyridyl)-2-pyrrolidinone
(-)-Cotinine HCl
Methyl N-formyl-4-(3'-pyridyl)-4-methylaminobutanoate
3-[(2S,5R)-5-ethyl-1-methylpyrrolidin-2-yl]pyridine
2'S,5'R-5'-ETHYLNICOTINE
5'-Hydroxy-nicotine
1-isopropyl-5-phenyl-2-pyrrolidone
6-HYDROXY-(S)-NICOTINE
2-Chloranyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine
6-CHLORO-(S)-NICOTINE
2-chloro-5-(1-methylpyrrolidin-2-yl)pyridine
| Title | Journal or Book | Year |
|---|---|---|
| The Syntheses of 4-Aminonicotine and 4-Aminocotinine | HETEROCYCLES | 1985 |
This compound is available in the following databases:
Mass Spectra of Designer Drugs 2024
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KnowItAll NMR Spectral Library
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KnowItAll IR, Raman, and UV-Vis Spectral Libraries
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KnowItAll Mass Spectral Library
Author: Wiley
The KnowItAll Mass Spectral Library offers a comprehensive collection of mass spectra, including the renowned Wiley Registry, and access to a wide range of compounds including pure organics, drugs, steroids, additives, geochemicals, petrochemicals, biomarkers, and more. Learn more.
Maurer, Meyer, Pfleger, Weber: GC-MS Library of Drugs, Poisons, and Their Metabolites 6th Edition
Author: Hans H. Maurer, Markus Meyer, Karl Pfleger, Armin A. Weber
Identification of trace drugs, poisons, and pollutants requires broad coverage of specific compound classes: metabolites, acetylated, methylated, trimethylsilylated, trifluoroacetylated, pentafluoropropionylated, and heptafluorobutyrylated compounds. Learn more.