CID 3043775

Benzenamine, 4,4'-(bromoethenylidene)bis-

Structural Information

Molecular Formula
C14H13BrN2
SMILES
C1=CC(=CC=C1C(=CBr)C2=CC=C(C=C2)N)N
InChI
InChI=1S/C14H13BrN2/c15-9-14(10-1-5-12(16)6-2-10)11-3-7-13(17)8-4-11/h1-9H,16-17H2
InChIKey
DLEAINKKTWRUTI-UHFFFAOYSA-N
Compound name
4-[1-(4-aminophenyl)-2-bromoethenyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.0262 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.03348 159.7
[M+Na]+ 311.01542 169.1
[M-H]- 287.01892 167.7
[M+NH4]+ 306.06002 177.7
[M+K]+ 326.98936 155.6
[M+H-H2O]+ 271.02346 157.7
[M+HCOO]- 333.02440 181.2
[M+CH3COO]- 347.04005 201.4
[M+Na-2H]- 309.00087 164.3
[M]+ 288.02565 173.5
[M]- 288.02675 173.5
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.