CID 125424351

182243-54-5

Structural Information

Molecular Formula
C4H4F7N
SMILES
C(C(C(F)(F)F)(C(F)(F)F)F)N
InChI
InChI=1S/C4H4F7N/c5-2(1-12,3(6,7)8)4(9,10)11/h1,12H2
InChIKey
WRAHZJQESWMXQC-UHFFFAOYSA-N
Compound name
2,3,3,3-tetrafluoro-2-(trifluoromethyl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

0
Patents

199.0232 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.03048 131.7
[M+Na]+ 222.01242 140.5
[M-H]- 198.01592 123.2
[M+NH4]+ 217.05702 150.1
[M+K]+ 237.98636 138.7
[M+H-H2O]+ 182.02046 122.4
[M+HCOO]- 244.02140 144.2
[M+CH3COO]- 258.03705 185.5
[M+Na-2H]- 219.99787 136.8
[M]+ 199.02265 119.2
[M]- 199.02375 119.2
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

No patent data available for this compound.