CID 68846218

2-(difluoromethyl)morpholine

Structural Information

Molecular Formula
C5H9F2NO
SMILES
C1COC(CN1)C(F)F
InChI
InChI=1S/C5H9F2NO/c6-5(7)4-3-8-1-2-9-4/h4-5,8H,1-3H2
InChIKey
BPZYLTBLBSNUNY-UHFFFAOYSA-N
Compound name
2-(difluoromethyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

90
Patents

137.06522 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.07250 129.9
[M+Na]+ 160.05444 138.4
[M+NH4]+ 155.09904 136.6
[M+K]+ 176.02838 134.0
[M-H]- 136.05794 128.8
[M+Na-2H]- 158.03989 132.7
[M]+ 137.06467 130.3
[M]- 137.06577 130.3
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