CID 69646

Ethyl trifluoromethyl ether

Structural Information

Molecular Formula
C3H5F3O
SMILES
CCOC(F)(F)F
InChI
InChI=1S/C3H5F3O/c1-2-7-3(4,5)6/h2H2,1H3
InChIKey
ZPVFXWAIPNKSLJ-UHFFFAOYSA-N
Compound name
trifluoromethoxyethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

919
Patents

114.02925 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.03653 125.0
[M+Na]+ 137.01847 133.1
[M+NH4]+ 132.06307 131.1
[M+K]+ 152.99241 128.6
[M-H]- 113.02197 120.1
[M+Na-2H]- 135.00392 127.6
[M]+ 114.02870 124.4
[M]- 114.02980 124.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe