GNPS Library Spectrum CCMSLIB00000220291

380
400
420
440
460
480
500
520
540
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 IDCCMSLIB00000220291
Compound NameMassbank:KO003888 Phosphoramidon
PIPutative Massbank Match
Data CollectorMassbank
CAS Number36357-77-4
Original Submittermwang87
Most Recent Revisormwang87
Library QualityBronze Spectrum
SmilesCC(C)C[C@@H](C(=O)N[C@H](C(O)=O)Cc(c2)c(c3)c(ccc3)n2)NP(O)(=O)O[C@H](O1)[C@H](O)[C@H](O)[C@@H](O)[C@H](C)1
InChI1S/C23H34N3O10P/c1-11(2)8-16(26-37(33,34)36-23-20(29)19(28)18(27)12(3)35-23)21(30)25-17(22(31)32)9-13-10-24-15-7-5-4-6-14(13)15/h4-7,10-12,16-20,23-24,27-29H,8-9H2,1-3H3,(H,25,30)(H,31,32)(H2,26,33,34)/t12-,16-,17-,18-,19+,20+,23-/m0/s1
Structure
NPAtlas/MIBiG
External Chemical ResourcesView All External Resources
Metabolomics Spectrum Resolvermzspec:GNPS:MASSBANK:accession:CCMSLIB00000220291
Precursor M/Z544.0
Exact Mass0.0
Charge1
Adduct[M+H]+
Ion SourceESI
InstrumentLC-ESI-QQ
Ion ModePositive
Spectrum Provenance Input FileDownload Provenance File
Download Library Spectrum PeaksDownload Spectrum Peaks
Library MembershipMASSBANK
SPLASH Keysplash10-014m-0009030000-a5b6407e17e402eec55c
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
1CommentMassbank:KO003888 PhosphoramidonPutative Massbank Match[M+H]+Massbank544.0mwang87N/A2014-08-01 16:31:38.0

Spectrum ID Ratings