CID 50989724

2,2-difluorocyclobutan-1-amine hydrochloride

Structural Information

Molecular Formula
C4H7F2N
SMILES
C1CC(C1N)(F)F
InChI
InChI=1S/C4H7F2N/c5-4(6)2-1-3(4)7/h3H,1-2,7H2
InChIKey
UHJMTZCOQFSWEC-UHFFFAOYSA-N
Compound name
2,2-difluorocyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

46
Patents

107.05466 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 108.06194 117.7
[M+Na]+ 130.04388 125.1
[M-H]- 106.04738 119.0
[M+NH4]+ 125.08848 135.7
[M+K]+ 146.01782 127.1
[M+H-H2O]+ 90.051920 107.7
[M+HCOO]- 152.05286 138.7
[M+CH3COO]- 166.06851 173.0
[M+Na-2H]- 128.02933 123.8
[M]+ 107.05411 120.6
[M]- 107.05521 120.6
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