CID 97205

Pyridine, 3-((o-chlorophenyl)azo)-2,6-diamino-

Structural Information

Molecular Formula
C11H10ClN5
SMILES
C1=CC=C(C(=C1)N=NC2=C(N=C(C=C2)N)N)Cl
InChI
InChI=1S/C11H10ClN5/c12-7-3-1-2-4-8(7)16-17-9-5-6-10(13)15-11(9)14/h1-6H,(H4,13,14,15)
InChIKey
FMSVBEHFAIKRNX-UHFFFAOYSA-N
Compound name
3-[(2-chlorophenyl)diazenyl]pyridine-2,6-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

9
Patents

247.06247 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.06975 154.1
[M+Na]+ 270.05169 163.4
[M-H]- 246.05519 161.8
[M+NH4]+ 265.09629 170.8
[M+K]+ 286.02563 158.6
[M+H-H2O]+ 230.05973 145.7
[M+HCOO]- 292.06067 179.5
[M+CH3COO]- 306.07632 205.1
[M+Na-2H]- 268.03714 161.4
[M]+ 247.06192 154.2
[M]- 247.06302 154.2
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