GNPS Library Spectrum CCMSLIB00001058222

125
150
175
200
225
250
275
300
325
350
0%
10%
20%
30%
40%
50%
60%
70%
80%
90%
100%
Click and drag in the plot to zoom X:  Y:        Enable tooltip Plot mass error
Latest Library Spectrum Information
Spectrum IDCCMSLIB00001058222
Compound NameEicosanoids_PGJ2_C20H30O4
PIDorrestein/Wu
Data Collectorlfnothias
Pubmedn/a
CAS Number60203-57-8
Original Submittermwang87
Most Recent Revisormwang87
Library QualityGold Spectrum
Smilesn/a
InChIInChI=1S/C20H30O4/c1-2-3-6-10-17(21)13-14-18-16(12-15-19(18)22)9-7-4-5-8-11-20(23)24/h4,7,12-18,21H,2-3,5-6,8-11H2,1H3,(H,23,24)/b7-4-,14-13+/t16-,17-,18+/m0/s1
Structure
NPAtlas/MIBiG
External Chemical ResourcesView All External Resources
Metabolomics Spectrum Resolvermzspec:GNPS:GNPS-COLLECTIONS-MISC:accession:CCMSLIB00001058222
Precursor M/Z357.204
Exact Mass334.215
Charge1
AdductM+Na
Ion SourceLC-ESI
InstrumentMaxis II HD Q-TOF Bruker
Ion Modepositive
Provenance LCMS File ViewerView Provenance Full LCMS File
Spectrum Provenance Input FileDownload Provenance File
Download Library Spectrum PeaksDownload Spectrum Peaks
Library MembershipGNPS-COLLECTIONS-MISC
SPLASH Keynull-null-null-null
Update Annotation
Add Spectrum Tag

Spectrum Tags

Datasets ID
Hits 1 ~ 0 out of 0     Go to   
TypeDescriptionDatabaseURLURLRemove Tag
checked only

Spectrum Annotation History

Spectrum Annotations and Comments
Hits 1 ~ 1 out of 1     Go to   
CommentCompound NamePIAdductData_CollectorPrecursor_MZuser_idPubmed IDTime
checked only
1CommentEicosanoids_PGJ2_C20H30O4Dorrestein/WuM+Nalfnothias357.204mwang87n/a2017-03-21 12:07:51.0

Spectrum ID Ratings