CID 131539235

2639423-41-7

Structural Information

Molecular Formula
C5H7F4N
SMILES
C1C(CC1(C(F)(F)F)N)F
InChI
InChI=1S/C5H7F4N/c6-3-1-4(10,2-3)5(7,8)9/h3H,1-2,10H2
InChIKey
LBOVXFUYPYYPCS-UHFFFAOYSA-N
Compound name
3-fluoro-1-(trifluoromethyl)cyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.05147 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.058746 129.7
[M+Na]+ 180.040688 137.3
[M-H]- 156.044194 128.4
[M+NH4]+ 175.085293 145.7
[M+K]+ 196.014628 138.5
[M+H-H2O]+ 140.048730 118.2
[M+HCOO]- 202.049671 146.7
[M+CH3COO]- 216.065321 181.2
[M+Na-2H]- 178.026136 134.5
[M]+ 157.05092142 129.7
[M]- 157.05201858 129.7
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.