CID 101672

2-chloro-1,1-difluoropropane

Structural Information

Molecular Formula
C3H5ClF2
SMILES
CC(C(F)F)Cl
InChI
InChI=1S/C3H5ClF2/c1-2(4)3(5)6/h2-3H,1H3
InChIKey
JYFZWZHSYZSPLO-UHFFFAOYSA-N
Compound name
2-chloro-1,1-difluoropropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

99
Patents

114.00478 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.01206 114.0
[M+Na]+ 136.99400 122.8
[M-H]- 112.99750 112.1
[M+NH4]+ 132.03860 137.5
[M+K]+ 152.96794 121.4
[M+H-H2O]+ 97.002040 109.5
[M+HCOO]- 159.00298 130.2
[M+CH3COO]- 173.01863 169.5
[M+Na-2H]- 134.97945 118.9
[M]+ 114.00423 112.3
[M]- 114.00533 112.3
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