CID 22397496

4-(2,4-difluorophenoxy)piperidine

Structural Information

Molecular Formula
C11H13F2NO
SMILES
C1CNCCC1OC2=C(C=C(C=C2)F)F
InChI
InChI=1S/C11H13F2NO/c12-8-1-2-11(10(13)7-8)15-9-3-5-14-6-4-9/h1-2,7,9,14H,3-6H2
InChIKey
LJTKODIQFDAGSL-UHFFFAOYSA-N
Compound name
4-(2,4-difluorophenoxy)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

114
Patents

213.09653 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.10381 144.7
[M+Na]+ 236.08575 151.1
[M-H]- 212.08925 145.5
[M+NH4]+ 231.13035 161.1
[M+K]+ 252.05969 147.0
[M+H-H2O]+ 196.09379 135.5
[M+HCOO]- 258.09473 161.0
[M+CH3COO]- 272.11038 183.7
[M+Na-2H]- 234.07120 148.2
[M]+ 213.09598 137.0
[M]- 213.09708 137.0
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

patents stripe