CID 137964395

2,2-difluoro-2-(3-hydroxyazetidin-3-yl)-n-methylacetamide hydrochloride

Structural Information

Molecular Formula
C6H10F2N2O2
SMILES
CNC(=O)C(C1(CNC1)O)(F)F
InChI
InChI=1S/C6H10F2N2O2/c1-9-4(11)6(7,8)5(12)2-10-3-5/h10,12H,2-3H2,1H3,(H,9,11)
InChIKey
NGJPMNMJMJFMHX-UHFFFAOYSA-N
Compound name
2,2-difluoro-2-(3-hydroxyazetidin-3-yl)-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

180.07103 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.07831 141.0
[M+Na]+ 203.06025 145.8
[M-H]- 179.06375 137.9
[M+NH4]+ 198.10485 153.0
[M+K]+ 219.03419 147.1
[M+H-H2O]+ 163.06829 129.6
[M+HCOO]- 225.06923 155.6
[M+CH3COO]- 239.08488 179.5
[M+Na-2H]- 201.04570 145.7
[M]+ 180.07048 142.7
[M]- 180.07158 142.7
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.