GNPS Library Spectrum CCMSLIB00000424789

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Latest Library Spectrum Information
Spectrum IDCCMSLIB00000424789
Compound NameQuinidine
PINorberto Lopes
Data CollectorLucas Marques
Pubmed
CAS Number56-54-2
Original Submitter10mauriz
Most Recent Revisor10mauriz
Library QualityBronze Spectrum
SmilesCOC1=CC=C(N=CC=C2[C@@](O)([H])C3N4CC(C=C)C(CC4)C3)C2=C1
InChIInChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13?,14?,19?,20-/m0/s1
Structure
NPAtlas/MIBiG
External Chemical ResourcesView All External Resources
Metabolomics Spectrum Resolvermzspec:GNPS:GNPS-LIBRARY:accession:CCMSLIB00000424789
Precursor M/Z325.19
Exact Mass324.184
Charge1
AdductM+H
Ion SourceDI-ESI
InstrumentqTof
Ion ModePositive
Spectrum Provenance Input FileDownload Provenance File
Download Library Spectrum PeaksDownload Spectrum Peaks
Library MembershipGNPS-LIBRARY
SPLASH Keysplash10-004i-0109000000-7e6773c319f4a18c6015
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Spectrum Annotation History

Spectrum Annotations and Comments
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CommentCompound NamePIAdductData_CollectorPrecursor_MZuser_idPubmed IDTime
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1CommentQuinidineNorberto LopesM+HLucas Marques325.1910mauriz 2014-12-15 04:13:59.0

Spectrum ID Ratings