CID 58421763

917383-03-0

Structural Information

Molecular Formula
C9H15F2NO2
SMILES
CN(C(=O)C1CCC(CC1)(F)F)OC
InChI
InChI=1S/C9H15F2NO2/c1-12(14-2)8(13)7-3-5-9(10,11)6-4-7/h7H,3-6H2,1-2H3
InChIKey
QGDRGVWTVHQUOL-UHFFFAOYSA-N
Compound name
4,4-difluoro-N-methoxy-N-methylcyclohexane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

152
Patents

207.10709 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.11437 142.9
[M+Na]+ 230.09631 148.5
[M-H]- 206.09981 144.7
[M+NH4]+ 225.14091 163.9
[M+K]+ 246.07025 148.9
[M+H-H2O]+ 190.10435 135.9
[M+HCOO]- 252.10529 162.1
[M+CH3COO]- 266.12094 190.3
[M+Na-2H]- 228.08176 145.7
[M]+ 207.10654 138.8
[M]- 207.10764 138.8
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