CID 24212022

902836-83-3

Structural Information

Molecular Formula
C14H13ClFNO
SMILES
CNCC1=C(C=CC=C1F)OC2=CC=C(C=C2)Cl
InChI
InChI=1S/C14H13ClFNO/c1-17-9-12-13(16)3-2-4-14(12)18-11-7-5-10(15)6-8-11/h2-8,17H,9H2,1H3
InChIKey
BODUZKATGHNYGG-UHFFFAOYSA-N
Compound name
1-[2-(4-chlorophenoxy)-6-fluorophenyl]-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.06696 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.07424 156.6
[M+Na]+ 288.05618 171.7
[M+NH4]+ 283.10078 165.6
[M+K]+ 304.03012 162.6
[M-H]- 264.05968 161.0
[M+Na-2H]- 286.04163 166.1
[M]+ 265.06641 160.4
[M]- 265.06751 160.4
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.