CID 64984805

2095409-18-8

Structural Information

Molecular Formula
C4H8F3NO
SMILES
COCC(C(F)(F)F)N
InChI
InChI=1S/C4H8F3NO/c1-9-2-3(8)4(5,6)7/h3H,2,8H2,1H3
InChIKey
FMXMGKMGLWWJQU-UHFFFAOYSA-N
Compound name
1,1,1-trifluoro-3-methoxypropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

143.0558 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.063076 124.7
[M+Na]+ 166.045018 132.2
[M-H]- 142.048524 120.9
[M+NH4]+ 161.089623 145.7
[M+K]+ 182.018958 132.2
[M+H-H2O]+ 126.053060 117.9
[M+HCOO]- 188.054001 144.0
[M+CH3COO]- 202.069651 176.0
[M+Na-2H]- 164.030466 129.5
[M]+ 143.05525142 119.8
[M]- 143.05634858 119.8
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