CID 165750453

2,2-difluoro-5-methylmorpholinehydrochloride

Structural Information

Molecular Formula
C5H9F2NO
SMILES
CC1COC(CN1)(F)F
InChI
InChI=1S/C5H9F2NO/c1-4-2-9-5(6,7)3-8-4/h4,8H,2-3H2,1H3
InChIKey
BRQIDWATCIYSMX-UHFFFAOYSA-N
Compound name
2,2-difluoro-5-methylmorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

137.06522 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.07250 129.3
[M+Na]+ 160.05444 138.7
[M+NH4]+ 155.09904 137.6
[M+K]+ 176.02838 132.2
[M-H]- 136.05794 128.5
[M+Na-2H]- 158.03989 133.8
[M]+ 137.06467 130.2
[M]- 137.06577 130.2
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.