CID 122163901

2-(pentafluoroethyl)-1,3-dioxolan-2-amine

Structural Information

Molecular Formula
C5H6F5NO2
SMILES
C1COC(O1)(C(C(F)(F)F)(F)F)N
InChI
InChI=1S/C5H6F5NO2/c6-3(7,4(8,9)10)5(11)12-1-2-13-5/h1-2,11H2
InChIKey
LXHZOUJRUMBHIA-UHFFFAOYSA-N
Compound name
2-(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.03188 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.03916 132.8
[M+Na]+ 230.02110 140.8
[M-H]- 206.02460 130.8
[M+NH4]+ 225.06570 151.9
[M+K]+ 245.99504 141.9
[M+H-H2O]+ 190.02914 125.5
[M+HCOO]- 252.03008 146.9
[M+CH3COO]- 266.04573 182.2
[M+Na-2H]- 228.00655 140.4
[M]+ 207.03133 124.4
[M]- 207.03243 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.