CID 121553433

1-(2,2-difluorocyclopropyl)ethan-1-amine hydrochloride

Structural Information

Molecular Formula
C5H9F2N
SMILES
CC(C1CC1(F)F)N
InChI
InChI=1S/C5H9F2N/c1-3(8)4-2-5(4,6)7/h3-4H,2,8H2,1H3
InChIKey
GPYXLJTYTVJBQZ-UHFFFAOYSA-N
Compound name
1-(2,2-difluorocyclopropyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

121.070305 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.077581 116.9
[M+Na]+ 144.059523 126.9
[M-H]- 120.063029 119.3
[M+NH4]+ 139.104128 136.0
[M+K]+ 160.033463 125.6
[M+H-H2O]+ 104.067565 111.1
[M+HCOO]- 166.068506 138.5
[M+CH3COO]- 180.084156 177.3
[M+Na-2H]- 142.044971 122.8
[M]+ 121.06975642 115.2
[M]- 121.07085358 115.2
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