CID 2775051

2-(2,3-dimethylphenoxy)pyridin-3-amine

Structural Information

Molecular Formula
C13H14N2O
SMILES
CC1=C(C(=CC=C1)OC2=C(C=CC=N2)N)C
InChI
InChI=1S/C13H14N2O/c1-9-5-3-7-12(10(9)2)16-13-11(14)6-4-8-15-13/h3-8H,14H2,1-2H3
InChIKey
PIQSAGQZHVNDSE-UHFFFAOYSA-N
Compound name
2-(2,3-dimethylphenoxy)pyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

80
Patents

214.11061 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.117886 147.5
[M+Na]+ 237.099828 156.6
[M-H]- 213.103334 153.2
[M+NH4]+ 232.144433 164.8
[M+K]+ 253.073768 152.9
[M+H-H2O]+ 197.107870 139.7
[M+HCOO]- 259.108811 171.6
[M+CH3COO]- 273.124461 191.3
[M+Na-2H]- 235.085276 153.4
[M]+ 214.11006142 147.7
[M]- 214.11115858 147.7
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