CID 75488623

4-(difluoromethoxy)cyclohexan-1-amine

Structural Information

Molecular Formula
C7H13F2NO
SMILES
C1CC(CCC1N)OC(F)F
InChI
InChI=1S/C7H13F2NO/c8-7(9)11-6-3-1-5(10)2-4-6/h5-7H,1-4,10H2
InChIKey
NRPDIKHIOPBBKH-UHFFFAOYSA-N
Compound name
4-(difluoromethoxy)cyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

165.09653 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.10381 135.7
[M+Na]+ 188.08575 143.1
[M+NH4]+ 183.13035 142.8
[M+K]+ 204.05969 138.4
[M-H]- 164.08925 134.7
[M+Na-2H]- 186.07120 138.7
[M]+ 165.09598 136.0
[M]- 165.09708 136.0
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