GNPS Library Spectrum CCMSLIB00000078904

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Latest Library Spectrum Information
Spectrum IDCCMSLIB00000078904
Compound NameROSIGLITAZONE MALEATE
PIDorrestein
Data CollectorGarg_Neha
CAS NumberN/A
Original Submitternegarg
Most Recent Revisornegarg
Library QualityGold Spectrum
SmilesCN(CCOc1ccc(CC2SC(=O)NC2=O)cc1)c3ccccn3
InChIN/A
Structure
NPAtlas/MIBiG
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Metabolomics Spectrum Resolvermzspec:GNPS:GNPS-NIH-CLINICALCOLLECTION1:accession:CCMSLIB00000078904
Precursor M/Z358.122
Exact Mass357.115
Charge1
Adduct[M+H]
Ion SourceLC-ESI
InstrumentqTof
Ion ModePositive
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Library MembershipGNPS-NIH-CLINICALCOLLECTION1
SPLASH Keysplash10-0a4r-1609000000-585d240b82e4a1918a29
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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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1CommentROSIGLITAZONE MALEATEDorrestein[M+H]Garg_Neha358.122negargN/A2014-05-06 20:38:41.0

Spectrum ID Ratings