CID 14028521

Isopropylphosphonyl difluoride

Structural Information

Molecular Formula
C3H7F2OP
SMILES
CC(C)P(=O)(F)F
InChI
InChI=1S/C3H7F2OP/c1-3(2)7(4,5)6/h3H,1-2H3
InChIKey
NBWFYJGIJLTFBE-UHFFFAOYSA-N
Compound name
2-difluorophosphorylpropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

128.02026 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.02754 123.2
[M+Na]+ 151.00948 131.8
[M-H]- 127.01298 120.3
[M+NH4]+ 146.05408 146.0
[M+K]+ 166.98342 132.0
[M+H-H2O]+ 111.01752 115.8
[M+HCOO]- 173.01846 148.9
[M+CH3COO]- 187.03411 172.8
[M+Na-2H]- 148.99493 126.4
[M]+ 128.01971 122.3
[M]- 128.02081 122.3
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