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

457
Patents

121.070305 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.07758 119.5
[M+Na]+ 144.05952 127.5
[M-H]- 120.06303 120.2
[M+NH4]+ 139.10413 145.1
[M+K]+ 160.03346 126.1
[M+H-H2O]+ 104.06756 113.8
[M+HCOO]- 166.06851 141.4
[M+CH3COO]- 180.08416 170.4
[M+Na-2H]- 142.04497 124.2
[M]+ 121.06976 112.2
[M]- 121.07085 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