CID 9578589

Brn 3348209

Structural Information

Molecular Formula
C13H9BrCl2N2
SMILES
C1=CC(=C(C(=C1)Cl)/C=N/NC2=CC=C(C=C2)Br)Cl
InChI
InChI=1S/C13H9BrCl2N2/c14-9-4-6-10(7-5-9)18-17-8-11-12(15)2-1-3-13(11)16/h1-8,18H/b17-8+
InChIKey
LEZKRCGMVBQXMN-CAOOACKPSA-N
Compound name
4-bromo-N-[(E)-(2,6-dichlorophenyl)methylideneamino]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.93262 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.93990 166.4
[M+Na]+ 364.92184 173.2
[M+NH4]+ 359.96644 172.5
[M+K]+ 380.89578 169.2
[M-H]- 340.92534 170.9
[M+Na-2H]- 362.90729 173.1
[M]+ 341.93207 168.2
[M]- 341.93317 168.2
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.