CID 9546719

Pc(p-15:0/0:0)

Structural Information

Molecular Formula
C23H49NO6P
SMILES
CCCCCCCCCCCCC/C=C\OC[C@H](COP(=O)(O)OCC[N+](C)(C)C)O
InChI
InChI=1S/C23H48NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-19-28-21-23(25)22-30-31(26,27)29-20-18-24(2,3)4/h17,19,23,25H,5-16,18,20-22H2,1-4H3/p+1/b19-17-/t23-/m1/s1
InChIKey
CORCYSWIDKFRAW-HIVNOOBXSA-O
Compound name
2-[hydroxy-[(2R)-2-hydroxy-3-[(Z)-pentadec-1-enoxy]propoxy]phosphoryl]oxyethyl-trimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

466.32974 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 467.33702 221.4
[M+Na]+ 489.31896 224.7
[M-H]- 465.32246 216.0
[M+NH4]+ 484.36356 222.6
[M+K]+ 505.29290 219.5
[M+H-H2O]+ 449.32700 206.0
[M+HCOO]- 511.32794 235.9
[M+CH3COO]- 525.34359 230.8
[M+Na-2H]- 487.30441 206.1
[M]+ 466.32919 217.7
[M]- 466.33029 217.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe