CID 2735906

2-(2,4-difluorophenoxy)-3-pyridinamine

Structural Information

Molecular Formula
C11H8F2N2O
SMILES
C1=CC(=C(N=C1)OC2=C(C=C(C=C2)F)F)N
InChI
InChI=1S/C11H8F2N2O/c12-7-3-4-10(8(13)6-7)16-11-9(14)2-1-5-15-11/h1-6H,14H2
InChIKey
LCPVQAHEFVXVKT-UHFFFAOYSA-N
Compound name
2-(2,4-difluorophenoxy)pyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

91348
Patents

222.06047 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.06775 144.0
[M+Na]+ 245.04969 154.0
[M-H]- 221.05319 147.1
[M+NH4]+ 240.09429 160.6
[M+K]+ 261.02363 149.7
[M+H-H2O]+ 205.05773 134.4
[M+HCOO]- 267.05867 166.5
[M+CH3COO]- 281.07432 190.7
[M+Na-2H]- 243.03514 149.7
[M]+ 222.05992 141.2
[M]- 222.06102 141.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe