CID 52161155

2580249-39-2

Structural Information

Molecular Formula
C14H18FNO
SMILES
C1CCC(CC1)NCC(=O)C2=CC=C(C=C2)F
InChI
InChI=1S/C14H18FNO/c15-12-8-6-11(7-9-12)14(17)10-16-13-4-2-1-3-5-13/h6-9,13,16H,1-5,10H2
InChIKey
FTFWWXGDWNBAAF-UHFFFAOYSA-N
Compound name
2-(cyclohexylamino)-1-(4-fluorophenyl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

235.13724 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.14452 155.8
[M+Na]+ 258.12646 166.3
[M+NH4]+ 253.17106 164.0
[M+K]+ 274.10040 158.9
[M-H]- 234.12996 159.1
[M+Na-2H]- 256.11191 162.4
[M]+ 235.13669 158.0
[M]- 235.13779 158.0
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

No patent data available for this compound.