CID 12758276

3-(1-phenylethoxy)pyridin-2-amine

Structural Information

Molecular Formula
C13H14N2O
SMILES
CC(C1=CC=CC=C1)OC2=C(N=CC=C2)N
InChI
InChI=1S/C13H14N2O/c1-10(11-6-3-2-4-7-11)16-12-8-5-9-15-13(12)14/h2-10H,1H3,(H2,14,15)
InChIKey
PPDXZQYCEONNNJ-UHFFFAOYSA-N
Compound name
3-(1-phenylethoxy)pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

214.11061 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.117886 147.6
[M+Na]+ 237.099828 154.5
[M-H]- 213.103334 152.5
[M+NH4]+ 232.144433 164.1
[M+K]+ 253.073768 151.2
[M+H-H2O]+ 197.107870 139.4
[M+HCOO]- 259.108811 170.7
[M+CH3COO]- 273.124461 189.9
[M+Na-2H]- 235.085276 153.8
[M]+ 214.11006142 146.3
[M]- 214.11115858 146.3
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