CID 2060297

2-(2,2,2-trifluoroethoxy)ethanamine

Structural Information

Molecular Formula
C4H8F3NO
SMILES
C(COCC(F)(F)F)N
InChI
InChI=1S/C4H8F3NO/c5-4(6,7)3-9-2-1-8/h1-3,8H2
InChIKey
UJKUXHKKBUXJMN-UHFFFAOYSA-N
Compound name
2-(2,2,2-trifluoroethoxy)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

120
Patents

143.0558 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.06308 124.4
[M+Na]+ 166.04502 132.1
[M-H]- 142.04852 120.4
[M+NH4]+ 161.08962 145.4
[M+K]+ 182.01896 131.6
[M+H-H2O]+ 126.05306 117.5
[M+HCOO]- 188.05400 144.7
[M+CH3COO]- 202.06965 175.2
[M+Na-2H]- 164.03047 130.5
[M]+ 143.05525 120.1
[M]- 143.05635 120.1
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