CID 2801414

2-(2,4-dichlorophenoxy)pyridin-3-amine

Structural Information

Molecular Formula
C11H8Cl2N2O
SMILES
C1=CC(=C(N=C1)OC2=C(C=C(C=C2)Cl)Cl)N
InChI
InChI=1S/C11H8Cl2N2O/c12-7-3-4-10(8(13)6-7)16-11-9(14)2-1-5-15-11/h1-6H,14H2
InChIKey
PDJZNBHGWZVWAU-UHFFFAOYSA-N
Compound name
2-(2,4-dichlorophenoxy)pyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

254.00137 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.00865 150.6
[M+Na]+ 276.99059 161.5
[M-H]- 252.99409 155.3
[M+NH4]+ 272.03519 167.4
[M+K]+ 292.96453 155.3
[M+H-H2O]+ 236.99863 144.2
[M+HCOO]- 298.99957 165.5
[M+CH3COO]- 313.01522 163.3
[M+Na-2H]- 274.97604 156.2
[M]+ 254.00082 153.4
[M]- 254.00192 153.4
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

patents stripe