CID 16205521

2-hydroxyhexadecyl dihydrogen phosphate

Structural Information

Molecular Formula
C16H35O5P
SMILES
CCCCCCCCCCCCCCC(COP(=O)(O)O)O
InChI
InChI=1S/C16H35O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16(17)15-21-22(18,19)20/h16-17H,2-15H2,1H3,(H2,18,19,20)
InChIKey
RUWOTBASWCAIML-UHFFFAOYSA-N
Compound name
2-hydroxyhexadecyl dihydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

17
Patents

338.2222 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.22948 192.8
[M+Na]+ 361.21142 194.2
[M-H]- 337.21492 185.7
[M+NH4]+ 356.25602 183.5
[M+K]+ 377.18536 191.3
[M+H-H2O]+ 321.21946 184.4
[M+HCOO]- 383.22040 198.5
[M+CH3COO]- 397.23605 206.8
[M+Na-2H]- 359.19687 189.2
[M]+ 338.22165 199.0
[M]- 338.22275 199.0
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