CID 14950918

Cyclohexyl(4-fluorophenyl)methanamine

Structural Information

Molecular Formula
C13H18FN
SMILES
C1CCC(CC1)C(C2=CC=C(C=C2)F)N
InChI
InChI=1S/C13H18FN/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h6-10,13H,1-5,15H2
InChIKey
OYCUPNFRMCKIHN-UHFFFAOYSA-N
Compound name
cyclohexyl-(4-fluorophenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

207.14233 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.14961 147.3
[M+Na]+ 230.13155 151.1
[M-H]- 206.13505 151.1
[M+NH4]+ 225.17615 165.1
[M+K]+ 246.10549 147.6
[M+H-H2O]+ 190.13959 139.2
[M+HCOO]- 252.14053 166.0
[M+CH3COO]- 266.15618 188.9
[M+Na-2H]- 228.11700 149.6
[M]+ 207.14178 138.6
[M]- 207.14288 138.6
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