CID 108838

Pentadecyl dihydrogen phosphate

Structural Information

Molecular Formula
C15H33O4P
SMILES
CCCCCCCCCCCCCCCOP(=O)(O)O
InChI
InChI=1S/C15H33O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-20(16,17)18/h2-15H2,1H3,(H2,16,17,18)
InChIKey
HIEAVKFYHNFZNR-UHFFFAOYSA-N
Compound name
pentadecyl dihydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

322
Patents

308.21164 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.21892 179.0
[M+Na]+ 331.20086 184.6
[M+NH4]+ 326.24546 182.7
[M+K]+ 347.17480 179.4
[M-H]- 307.20436 174.7
[M+Na-2H]- 329.18631 177.5
[M]+ 308.21109 178.0
[M]- 308.21219 178.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe