GNPS Library Spectrum CCMSLIB00000425044

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Latest Library Spectrum Information
Spectrum IDCCMSLIB00000425044
Compound NameHMDB:HMDB00699-972 1-Methylnicotinamide
PIHMDB
Data CollectorHMDB
CAS Number3106-60-3
Original Submittermwang87
Most Recent Revisormwang87
Library QualityBronze Spectrum
SmilesC[N+]1=CC=CC(=C1)C(N)=O
InChIInChI=1S/C7H8N2O/c1-9-4-2-3-6(5-9)7(8)10/h2-5H,1H3,(H-,8,10)/p+1
Structure
NPAtlas/MIBiG
External Chemical ResourcesView All External Resources
Metabolomics Spectrum Resolvermzspec:GNPS:HMDB:accession:CCMSLIB00000425044
Precursor M/Z138.079
Exact Mass137.071
Charge1
AdductM+H
Ion SourcePositive
InstrumentQuattro_QQQ:10eV
Ion ModePositive
Spectrum Provenance Input FileDownload Provenance File
Download Library Spectrum PeaksDownload Spectrum Peaks
Library MembershipHMDB
SPLASH Keysplash10-000i-0900000000-c99e0e70357eb6fa74bb
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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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1CommentHMDB:HMDB00699-972 1-MethylnicotinamideHMDBM+HHMDB138.079mwang87N/A2015-02-20 17:07:30.0

Spectrum ID Ratings