CID 82287144

890147-13-4

Structural Information

Molecular Formula
C13H18FNO
SMILES
C1CCC(CC1)(C(C2=CC=C(C=C2)F)O)N
InChI
InChI=1S/C13H18FNO/c14-11-6-4-10(5-7-11)12(16)13(15)8-2-1-3-9-13/h4-7,12,16H,1-3,8-9,15H2
InChIKey
NPYYGMJPKBXIOB-UHFFFAOYSA-N
Compound name
(1-aminocyclohexyl)-(4-fluorophenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.13724 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.14452 152.0
[M+Na]+ 246.12646 161.9
[M+NH4]+ 241.17106 161.5
[M+K]+ 262.10040 153.8
[M-H]- 222.12996 154.8
[M+Na-2H]- 244.11191 159.5
[M]+ 223.13669 154.1
[M]- 223.13779 154.1
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.