CID 21072519

2309453-93-6

Structural Information

Molecular Formula
C4H7F4N
SMILES
C(CN)C(C(F)F)(F)F
InChI
InChI=1S/C4H7F4N/c5-3(6)4(7,8)1-2-9/h3H,1-2,9H2
InChIKey
ITMAWEQXKLVLOB-UHFFFAOYSA-N
Compound name
3,3,4,4-tetrafluorobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

145.05147 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.05875 134.9
[M+Na]+ 168.04069 140.2
[M+NH4]+ 163.08529 139.4
[M+K]+ 184.01463 136.6
[M-H]- 144.04419 129.0
[M+Na-2H]- 166.02614 135.8
[M]+ 145.05092 133.5
[M]- 145.05202 133.5
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

patents stripe