CID 13811893

4-fluoro-4-methylcyclohexan-1-amine hydrochloride

Structural Information

Molecular Formula
C7H14FN
SMILES
CC1(CCC(CC1)N)F
InChI
InChI=1S/C7H14FN/c1-7(8)4-2-6(9)3-5-7/h6H,2-5,9H2,1H3
InChIKey
GNPUYHNMNBNNQY-UHFFFAOYSA-N
Compound name
4-fluoro-4-methylcyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

131.11102 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.118296 126.8
[M+Na]+ 154.100238 133.0
[M-H]- 130.103744 128.4
[M+NH4]+ 149.144843 150.3
[M+K]+ 170.074178 131.7
[M+H-H2O]+ 114.108280 121.5
[M+HCOO]- 176.109221 147.0
[M+CH3COO]- 190.124871 173.9
[M+Na-2H]- 152.085686 132.1
[M]+ 131.11047142 119.3
[M]- 131.11156858 119.3
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