CID 72213137

2031258-87-2

Structural Information

Molecular Formula
C5H9F2N
SMILES
C1C(C1(F)F)CCN
InChI
InChI=1S/C5H9F2N/c6-5(7)3-4(5)1-2-8/h4H,1-3,8H2
InChIKey
JFMDNCKAFKFJTR-UHFFFAOYSA-N
Compound name
2-(2,2-difluorocyclopropyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

121.070305 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.077581 117.1
[M+Na]+ 144.059523 127.3
[M-H]- 120.063029 119.4
[M+NH4]+ 139.104128 136.2
[M+K]+ 160.033463 125.7
[M+H-H2O]+ 104.067565 111.1
[M+HCOO]- 166.068506 139.6
[M+CH3COO]- 180.084156 176.5
[M+Na-2H]- 142.044971 124.1
[M]+ 121.06975642 115.9
[M]- 121.07085358 115.9
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

No patent data available for this compound.