CID 67839

Perfluoro-n-methylmorpholine

Structural Information

Molecular Formula
C5F11NO
SMILES
C1(C(OC(C(N1C(F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C5F11NO/c6-1(7)3(10,11)18-4(12,13)2(8,9)17(1)5(14,15)16
InChIKey
PQMAKJUXOOVROI-UHFFFAOYSA-N
Compound name
2,2,3,3,5,5,6,6-octafluoro-4-(trifluoromethyl)morpholine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

3079
Patents

298.98044 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.98772 140.6
[M+Na]+ 321.96966 155.1
[M-H]- 297.97316 132.2
[M+NH4]+ 317.01426 160.9
[M+K]+ 337.94360 153.6
[M+H-H2O]+ 281.97770 130.2
[M+HCOO]- 343.97864 147.1
[M+CH3COO]- 357.99429 200.9
[M+Na-2H]- 319.95511 145.9
[M]+ 298.97989 126.3
[M]- 298.98099 126.3
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