CID 131519350

2307780-76-1

Structural Information

Molecular Formula
C5H9F2N
SMILES
C1C[C@H]([C@@H]1C(F)F)N
InChI
InChI=1S/C5H9F2N/c6-5(7)3-1-2-4(3)8/h3-5H,1-2,8H2/t3-,4-/m1/s1
InChIKey
XLYVASGSYGCJCL-QWWZWVQMSA-N
Compound name
(1R,2R)-2-(difluoromethyl)cyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

121.070305 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.07758 123.4
[M+Na]+ 144.05952 129.1
[M-H]- 120.06303 124.0
[M+NH4]+ 139.10413 138.7
[M+K]+ 160.03346 131.3
[M+H-H2O]+ 104.06756 111.6
[M+HCOO]- 166.06851 142.9
[M+CH3COO]- 180.08416 177.2
[M+Na-2H]- 142.04497 126.5
[M]+ 121.06976 125.5
[M]- 121.07085 125.5
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.