Dataset

Cotinine

This MassBank record with Accession MSBNK-Washington_State_Univ-BML80980 contains the MS mass spectrum of Cotinine with the InChIkey UIKROCXWUNQSPJ-UHFFFAOYSA-N.

Chemical Info

molecular Image
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
SMILES CN1C(CCC1=O)C2=CN=CC=C2
InChI Key UIKROCXWUNQSPJ-UHFFFAOYSA-N
Molecular Formula C10H12N2O
Exact Mass 176.095 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML80980
Version
Author
Maintainer
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MetadataCreated 2024-01-11T22:21:13.418599
MetadataModified 2025-02-09T20:11:02.237678
MetadataPublished 2016-01-19
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