GNPS Library Spectrum CCMSLIB00000072560

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Latest Library Spectrum Information
Spectrum IDCCMSLIB00000072560
Compound Namephenazine-1-carboxylic acid
PIDorrestein
Data CollectorWMoree
Pubmed22869730
CAS NumberN/A
Original Submittervphelan
Most Recent Revisorkimkami2
Library QualityGold Spectrum
SmilesC1=CC=C2C(=C1)N=C3C=CC=C(C3=N2)C(=O)O
InChIInChI=1S/C13H8N2O2/c16-13(17)8-4-3-7-11-12(8)15-10-6-2-1-5-9(10)14-11/h1-7H,(H,16,17)
Structure
NPAtlas/MIBiG
External Chemical ResourcesView All External Resources
Metabolomics Spectrum Resolvermzspec:GNPS:GNPS-LIBRARY:accession:CCMSLIB00000072560
Precursor M/Z225.0
Exact Mass224.059
Charge1
AdductM+H
Ion SourceDI-ESI
InstrumentHybrid FT
Ion ModePositive
Provenance LCMS File ViewerView Provenance Full LCMS File
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Library MembershipGNPS-LIBRARY
SPLASH Keysplash10-0a4i-0090000000-95afe17268a74a0878de
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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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1Commentphenazine-1-carboxylic acidDorresteinM+HWMoree225.0kimkami2228697302021-03-18 20:08:16.0
2Commentphenazine-1-carboxylic acidDorresteinM+HWMoree225.0vphelan228697302014-03-22 12:53:01.0

Spectrum ID Ratings