GNPS Library Spectrum CCMSLIB00000078707

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Latest Library Spectrum Information
Spectrum IDCCMSLIB00000078707
Compound Name"NCGC00160301-01!1-(4-Oxo-4H-chromen-3-yl)-2,3,4,9-tetrahydro-1H-beta-carbolin-3-ylcarboxylic acid"
PIDorrestein
Data CollectorVVP/LMS
CAS NumberN/A
Original Submittervphelan
Most Recent Revisorvphelan
Library QualityGold Spectrum
SmilesOC(=O)C1CC2=C(NC3=CC=CC=C23)C(N1)C4=COC5=CC=CC=C5C4=O
InChIN/A
Structure
NPAtlas/MIBiG
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Metabolomics Spectrum Resolvermzspec:GNPS:GNPS-PRESTWICKPHYTOCHEM:accession:CCMSLIB00000078707
Precursor M/Z361.119
Exact Mass360.111
Charge1
AdductM+H
Ion SourceLC-ESI
InstrumentqTOF
Ion ModePositive
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Library MembershipGNPS-PRESTWICKPHYTOCHEM
SPLASH Keysplash10-00di-0930000000-b5c2567c94de1cc622e7
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CommentCompound NamePIAdductData_CollectorPrecursor_MZuser_idPubmed IDTime
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1Comment
"NCGC00160301-01
1-(4-Oxo-4H-chromen-3-yl)-2,3,4,9-tetrahydro-1H-beta-carbolin-3-ylcarboxylic acid"
DorresteinM+HVVP/LMS361.119vphelanN/A2014-05-02 16:39:07.0

Spectrum ID Ratings