GNPS Library Spectrum CCMSLIB00000479565

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Latest Library Spectrum Information
Spectrum IDCCMSLIB00000479565
Compound Name1-Oleoyl-sn-glycero-3-phosphocholine
PIAlexandrov Theodore
Data CollectorPrasad
Pubmed16081932
CAS Number3542-29-8
Original Submitterpphapale
Most Recent Revisorpphapale
Library QualityGold Spectrum
SmilesN/A
InChI"InChI=1S/C26H52NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h12-13,25,28H,5-11,14-24H2,1-4H3/b13-12-/t25-/m1/s1"
Structure
NPAtlas/MIBiG
External Chemical ResourcesView All External Resources
Metabolomics Spectrum Resolvermzspec:GNPS:GNPS-EMBL-MCF:accession:CCMSLIB00000479565
Precursor M/Z522.356
Exact Mass521.348
Charge1
AdductM+H
Ion SourceDI-ESI
InstrumentOrbitrap
Ion ModePositive
Provenance LCMS File ViewerView Provenance Full LCMS File
Spectrum Provenance Input FileDownload Provenance File
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Library MembershipGNPS-EMBL-MCF
SPLASH Keysplash10-0f89-0900000000-f419b9b1355f202b7e5a
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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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1Comment1-Oleoyl-sn-glycero-3-phosphocholineAlexandrov TheodoreM+HPrasad522.356pphapale160819322017-12-11 00:55:25.0
2Comment1-Oleoyl-sn-glycero-3-phosphocholineAlexandrov TheodoreM+HPrasad522.356pphapale160819322017-02-01 06:46:40.0
3Comment1-Oleoyl-sn-glycero-3-phosphocholineAlexandrov TheodoreM+HPrasad521.67pphapale160819322015-08-16 10:50:49.0

Spectrum ID Ratings