CID 53410279

1220038-38-9

Structural Information

Molecular Formula
C11H10ClN3
SMILES
C1=CC(=NC(=C1)Cl)NCC2=CN=CC=C2
InChI
InChI=1S/C11H10ClN3/c12-10-4-1-5-11(15-10)14-8-9-3-2-6-13-7-9/h1-7H,8H2,(H,14,15)
InChIKey
HVZXGXWRRVBSFA-UHFFFAOYSA-N
Compound name
6-chloro-N-(pyridin-3-ylmethyl)pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.05632 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.063596 145.1
[M+Na]+ 242.045538 153.8
[M-H]- 218.049044 148.7
[M+NH4]+ 237.090143 161.1
[M+K]+ 258.019478 148.3
[M+H-H2O]+ 202.053580 136.6
[M+HCOO]- 264.054521 164.1
[M+CH3COO]- 278.070171 157.4
[M+Na-2H]- 240.030986 154.1
[M]+ 219.05577142 145.7
[M]- 219.05686858 145.7
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

No patent data available for this compound.