CID 9604783

N-[(z)-[2-imidazol-1-yl-1-(4-phenylphenyl)ethylidene]amino]pyridine-2-carboxamidine

Structural Information

Molecular Formula
C23H20N6
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)/C(=N/N=C(/C3=CC=CC=N3)\N)/CN4C=CN=C4
InChI
InChI=1S/C23H20N6/c24-23(21-8-4-5-13-26-21)28-27-22(16-29-15-14-25-17-29)20-11-9-19(10-12-20)18-6-2-1-3-7-18/h1-15,17H,16H2,(H2,24,28)/b27-22+
InChIKey
COJWYTFIPFZTDQ-HPNDGRJYSA-N
Compound name
N'-[(Z)-[2-imidazol-1-yl-1-(4-phenylphenyl)ethylidene]amino]pyridine-2-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

380.17496 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.18224 188.9
[M+Na]+ 403.16418 193.0
[M-H]- 379.16768 199.3
[M+NH4]+ 398.20878 196.8
[M+K]+ 419.13812 186.4
[M+H-H2O]+ 363.17222 175.3
[M+HCOO]- 425.17316 213.2
[M+CH3COO]- 439.18881 197.6
[M+Na-2H]- 401.14963 193.6
[M]+ 380.17441 186.4
[M]- 380.17551 186.4
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.