CID 9575364

N-[(e)-(2-chlorophenyl)methyleneamino]-3-phenyl-quinoxalin-2-amine

Structural Information

Molecular Formula
C21H15ClN4
SMILES
C1=CC=C(C=C1)C2=NC3=CC=CC=C3N=C2N/N=C/C4=CC=CC=C4Cl
InChI
InChI=1S/C21H15ClN4/c22-17-11-5-4-10-16(17)14-23-26-21-20(15-8-2-1-3-9-15)24-18-12-6-7-13-19(18)25-21/h1-14H,(H,25,26)/b23-14+
InChIKey
CDBHDGNAEMQEEG-OEAKJJBVSA-N
Compound name
N-[(E)-(2-chlorophenyl)methylideneamino]-3-phenylquinoxalin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

358.0985 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.10578 184.2
[M+Na]+ 381.08772 193.0
[M-H]- 357.09122 192.7
[M+NH4]+ 376.13232 195.4
[M+K]+ 397.06166 184.2
[M+H-H2O]+ 341.09576 172.3
[M+HCOO]- 403.09670 203.3
[M+CH3COO]- 417.11235 194.3
[M+Na-2H]- 379.07317 192.9
[M]+ 358.09795 185.8
[M]- 358.09905 185.8
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.