CID 53302322

939398-48-8

Structural Information

Molecular Formula
C5H9F2N
SMILES
C1CC(CC1N)(F)F
InChI
InChI=1S/C5H9F2N/c6-5(7)2-1-4(8)3-5/h4H,1-3,8H2
InChIKey
QLOHXGYAULHFOG-UHFFFAOYSA-N
Compound name
3,3-difluorocyclopentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

427
Patents

121.070305 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.077581 119.5
[M+Na]+ 144.059523 127.5
[M-H]- 120.063029 120.2
[M+NH4]+ 139.104128 145.1
[M+K]+ 160.033463 126.1
[M+H-H2O]+ 104.067565 113.8
[M+HCOO]- 166.068506 141.4
[M+CH3COO]- 180.084156 170.4
[M+Na-2H]- 142.044971 124.2
[M]+ 121.06975642 112.2
[M]- 121.07085358 112.2
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