CID 19059

Hexadecyl dihydrogen phosphate

Structural Information

Molecular Formula
C16H35O4P
SMILES
CCCCCCCCCCCCCCCCOP(=O)(O)O
InChI
InChI=1S/C16H35O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-21(17,18)19/h2-16H2,1H3,(H2,17,18,19)
InChIKey
ZUVCYFMOHFTGDM-UHFFFAOYSA-N
Compound name
hexadecyl dihydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

13
References

22466
Patents

322.2273 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.23458 189.7
[M+Na]+ 345.21652 191.9
[M-H]- 321.22002 184.0
[M+NH4]+ 340.26112 203.3
[M+K]+ 361.19046 188.7
[M+H-H2O]+ 305.22456 181.2
[M+HCOO]- 367.22550 211.7
[M+CH3COO]- 381.24115 206.5
[M+Na-2H]- 343.20197 187.6
[M]+ 322.22675 197.1
[M]- 322.22785 197.1
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

No patent data available for this compound.