SpectraBase Spectrum ID |
BZdMktdeLU0 |
Name |
Nicotine-M (cotinine) @ |
CAS Registry Number |
486-56-6 |
Classification |
Stimulant |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
176.094963013 u |
Formula |
C10H12N2O |
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 |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
176.219 g/mol |
SMILES |
c1ccc(C2N(C)C(=O)CC2)cn1 |
SPLASH |
splash10-0002-9400000000-def5ac5eed647da8e404 |
Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
Sample Preparation Procedure |
Detected: P U+UHYAC |
Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
Synonyms |
Cotinine |
Technique |
GC/MS |
Wiley ID |
MMPW6e_692 |