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]+ 129.027536 123.2
[M+Na]+ 151.009478 131.8
[M-H]- 127.012984 120.3
[M+NH4]+ 146.054083 146.0
[M+K]+ 166.983418 132.0
[M+H-H2O]+ 111.017520 115.8
[M+HCOO]- 173.018461 148.9
[M+CH3COO]- 187.034111 172.8
[M+Na-2H]- 148.994926 126.4
[M]+ 128.01971142 122.3
[M]- 128.02080858 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