CID 10558645

2-(trifluoromethoxy)ethan-1-amine hydrochloride

Structural Information

Molecular Formula
C3H6F3NO
SMILES
C(COC(F)(F)F)N
InChI
InChI=1S/C3H6F3NO/c4-3(5,6)8-2-1-7/h1-2,7H2
InChIKey
IJAQSERNJJEFFD-UHFFFAOYSA-N
Compound name
2-(trifluoromethoxy)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

382
Patents

129.04015 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.047426 119.7
[M+Na]+ 152.029368 127.8
[M-H]- 128.032874 115.9
[M+NH4]+ 147.073973 141.2
[M+K]+ 168.003308 127.6
[M+H-H2O]+ 112.037410 113.0
[M+HCOO]- 174.038351 140.3
[M+CH3COO]- 188.054001 172.1
[M+Na-2H]- 150.014816 126.3
[M]+ 129.03960142 115.0
[M]- 129.04069858 115.0
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