CID 14027070

2,2,3,3-tetrafluoropropyl dihydrogen phosphate

Structural Information

Molecular Formula
C3H5F4O4P
SMILES
C(C(C(F)F)(F)F)OP(=O)(O)O
InChI
InChI=1S/C3H5F4O4P/c4-2(5)3(6,7)1-11-12(8,9)10/h2H,1H2,(H2,8,9,10)
InChIKey
CQEJZHHECZXRFX-UHFFFAOYSA-N
Compound name
2,2,3,3-tetrafluoropropyl dihydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

36
Patents

211.98616 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.99344 138.2
[M+Na]+ 234.97538 146.2
[M-H]- 210.97888 129.9
[M+NH4]+ 230.01998 155.8
[M+K]+ 250.94932 145.5
[M+H-H2O]+ 194.98342 129.2
[M+HCOO]- 256.98436 157.8
[M+CH3COO]- 271.00001 179.7
[M+Na-2H]- 232.96083 140.7
[M]+ 211.98561 134.4
[M]- 211.98671 134.4
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