CID 752150

N1-(pyridin-2-yl)benzene-1,2-diamine

Structural Information

Molecular Formula
C11H11N3
SMILES
C1=CC=C(C(=C1)N)NC2=CC=CC=N2
InChI
InChI=1S/C11H11N3/c12-9-5-1-2-6-10(9)14-11-7-3-4-8-13-11/h1-8H,12H2,(H,13,14)
InChIKey
SMNUYINHUNGHMQ-UHFFFAOYSA-N
Compound name
2-N-pyridin-2-ylbenzene-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

185.09529 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.102566 137.9
[M+Na]+ 208.084508 145.2
[M-H]- 184.088014 143.1
[M+NH4]+ 203.129113 155.4
[M+K]+ 224.058448 141.2
[M+H-H2O]+ 168.092550 129.9
[M+HCOO]- 230.093491 163.5
[M+CH3COO]- 244.109141 150.9
[M+Na-2H]- 206.069956 147.0
[M]+ 185.09474142 134.5
[M]- 185.09583858 134.5
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