GNPS Library Spectrum CCMSLIB00005720914

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Latest Library Spectrum Information
Spectrum IDCCMSLIB00005720914
Compound NameFA(22:4) - 4.7.10.13-docosatetraenoic acid
PIO Laprevote
Data CollectorC-TAC
CAS NumberN/A
Original Submittermpanitchpakdi
Most Recent Revisorviceleonore
Library QualityBronze Spectrum
SmilesC(=C/C/C=C/CCCCCCCC)\C/C=C/C/C=C/CCC(=O)O
InChIN/A
Structure
NPAtlas/MIBiG
External Chemical ResourcesView All External Resources
Metabolomics Spectrum Resolvermzspec:GNPS:HCE-CELL-LYSATE-LIPIDS:accession:CCMSLIB00005720914
Precursor M/Z331.263
Exact Mass332.272
Charge1
AdductM-H
Ion SourceLC-ESI
InstrumentqTof
Ion ModeNegative
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Library MembershipHCE-CELL-LYSATE-LIPIDS
SPLASH Keynull-null-null-null
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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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1CommentFA(22:4) - 4.7.10.13-docosatetraenoic acidO LaprevoteM-HC-TAC331.263viceleonoreN/A2022-04-29 02:27:40.0
2Comment4.7.10.13-docosatetraenoic acidO LaprevoteM-HC-TAC331.263mpanitchpakdiN/A2020-04-15 09:13:03.0

Spectrum ID Ratings