GNPS Library Spectrum CCMSLIB00000479580

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Latest Library Spectrum Information
Spectrum IDCCMSLIB00000479580
Compound NameArachidonic acid
PIAlexandrov Theodore
Data CollectorPrasad
Pubmed444899
CAS Number506-32-1
Original Submitterpphapale
Most Recent Revisorpphapale
Library QualityGold Spectrum
SmilesN/A
InChI"InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-,16-15-"
Structure
NPAtlas/MIBiG
External Chemical ResourcesView All External Resources
Metabolomics Spectrum Resolvermzspec:GNPS:GNPS-EMBL-MCF:accession:CCMSLIB00000479580
Precursor M/Z303.232
Exact Mass304.24
Charge1
AdductM-H
Ion SourceDI-ESI
InstrumentOrbitrap
Ion ModeNegative
Provenance LCMS File ViewerView Provenance Full LCMS File
Spectrum Provenance Input FileDownload Provenance File
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Library MembershipGNPS-EMBL-MCF
SPLASH Keysplash10-0udi-1019000000-8ce3315cdbc9eb1b25f1
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Spectrum Tags

Datasets ID
Hits 1 ~ 1 out of 1     Go to   
TypeDescriptionDatabaseURLURLRemove Tag
checked only
1Sample Type DetectedHuman:PlasmaN/AN/Alinkout

Spectrum Annotation History

Spectrum Annotations and Comments
Hits 1 ~ 2 out of 2     Go to   
CommentCompound NamePIAdductData_CollectorPrecursor_MZuser_idPubmed IDTime
checked only
1CommentArachidonic acidAlexandrov TheodoreM-HPrasad303.232pphapale4448992017-02-01 06:57:22.0
2CommentArachidonic acidAlexandrov TheodoreM-HPrasad304.46pphapale4448992015-08-16 10:50:49.0

Spectrum ID Ratings