CID 58512214

(1-fluorocyclohexyl)methanamine hydrochloride

Structural Information

Molecular Formula
C7H14FN
SMILES
C1CCC(CC1)(CN)F
InChI
InChI=1S/C7H14FN/c8-7(6-9)4-2-1-3-5-7/h1-6,9H2
InChIKey
AATBWVUULWNXOC-UHFFFAOYSA-N
Compound name
(1-fluorocyclohexyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

50
Patents

131.11102 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.118296 127.4
[M+Na]+ 154.100238 132.6
[M-H]- 130.103744 128.6
[M+NH4]+ 149.144843 150.5
[M+K]+ 170.074178 131.4
[M+H-H2O]+ 114.108280 121.8
[M+HCOO]- 176.109221 147.6
[M+CH3COO]- 190.124871 172.8
[M+Na-2H]- 152.085686 133.3
[M]+ 131.11047142 119.6
[M]- 131.11156858 119.6
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