GNPS Library Spectrum CCMSLIB00005724070

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Latest Library Spectrum Information
Spectrum IDCCMSLIB00005724070
Compound NamePC(16:1_16:1) - (2-{[2.3-bis[hexadec-9-enoyloxy]propyl phosphonato]oxy}ethyl)trimethylazanium
PIN Auzeil
Data CollectorUMR CNRS 8038 Universite de Paris
CAS NumberN/A
Original Submittermpanitchpakdi
Most Recent Revisorviceleonore
Library QualityBronze Spectrum
SmilesCCCCCC\C=C/CCCCCCCC(=O)OC[C@]([H])(COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCC\C=C/CCCCCC
InChIN/A
Structure
NPAtlas/MIBiG
External Chemical ResourcesView All External Resources
Metabolomics Spectrum Resolvermzspec:GNPS:GNPS-IOBA-NHC:accession:CCMSLIB00005724070
Precursor M/Z730.538
Exact Mass729.531
Charge1
AdductM+H
Ion SourceLC-ESI
InstrumentqTof
Ion ModePositive
Provenance LCMS File ViewerView Provenance Full LCMS File
Spectrum Provenance Input FileDownload Provenance File
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Library MembershipGNPS-IOBA-NHC
SPLASH Keynull-null-null-null
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Spectrum Tags

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Spectrum Annotation History

Spectrum Annotations and Comments
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CommentCompound NamePIAdductData_CollectorPrecursor_MZuser_idPubmed IDTime
checked only
1CommentPC(16:1_16:1) - (2-{[2.3-bis[hexadec-9-enoyloxy]propyl phosphonato]oxy}ethyl)trimethylazaniumN AuzeilM+HUMR CNRS 8038 Universite de Paris730.538viceleonoreN/A2022-04-26 02:24:30.0
2Comment(2-{[2.3-bis[hexadec-9-enoyloxy]propyl phosphonato]oxy}ethyl)trimethylazaniumN AuzeilM+HUMR CNRS 8038 Universit� de Paris730.538mpanitchpakdiN/A2020-09-01 17:41:03.0

Spectrum ID Ratings