CID 9604779

N-[(z)-(2-imidazol-1-yl-1-phenyl-ethylidene)amino]pyridine-2-carboxamidine

Structural Information

Molecular Formula
C17H16N6
SMILES
C1=CC=C(C=C1)/C(=N/N=C(/C2=CC=CC=N2)\N)/CN3C=CN=C3
InChI
InChI=1S/C17H16N6/c18-17(15-8-4-5-9-20-15)22-21-16(12-23-11-10-19-13-23)14-6-2-1-3-7-14/h1-11,13H,12H2,(H2,18,22)/b21-16+
InChIKey
PFORGMJZNPXWFY-LTGZKZEYSA-N
Compound name
N'-[(Z)-(2-imidazol-1-yl-1-phenylethylidene)amino]pyridine-2-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.14365 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.15093 168.7
[M+Na]+ 327.13287 173.4
[M-H]- 303.13637 176.4
[M+NH4]+ 322.17747 180.2
[M+K]+ 343.10681 168.9
[M+H-H2O]+ 287.14091 156.4
[M+HCOO]- 349.14185 194.1
[M+CH3COO]- 363.15750 178.9
[M+Na-2H]- 325.11832 174.8
[M]+ 304.14310 166.5
[M]- 304.14420 166.5
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.