CID 46209411

1132785-26-2

Structural Information

Molecular Formula
C5H12FNO
SMILES
CN(CCO)CCF
InChI
InChI=1S/C5H12FNO/c1-7(3-2-6)4-5-8/h8H,2-5H2,1H3
InChIKey
NQICUMFZYPGYSW-UHFFFAOYSA-N
Compound name
2-[2-fluoroethyl(methyl)amino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

121.090294 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.097570 124.3
[M+Na]+ 144.079512 130.8
[M-H]- 120.083018 123.3
[M+NH4]+ 139.124117 146.4
[M+K]+ 160.053452 131.3
[M+H-H2O]+ 104.087554 118.6
[M+HCOO]- 166.088495 147.6
[M+CH3COO]- 180.104145 174.5
[M+Na-2H]- 142.064960 130.2
[M]+ 121.08974542 123.9
[M]- 121.09084258 123.9
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