CID 3043774

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

Structural Information

Molecular Formula
C14H13ClN2
SMILES
C1=CC(=CC=C1C(=CCl)C2=CC=C(C=C2)N)N
InChI
InChI=1S/C14H13ClN2/c15-9-14(10-1-5-12(16)6-2-10)11-3-7-13(17)8-4-11/h1-9H,16-17H2
InChIKey
DQHMFINWTOTBBV-UHFFFAOYSA-N
Compound name
4-[1-(4-aminophenyl)-2-chloroethenyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.07672 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.08400 155.6
[M+Na]+ 267.06594 163.4
[M-H]- 243.06944 161.4
[M+NH4]+ 262.11054 172.8
[M+K]+ 283.03988 156.7
[M+H-H2O]+ 227.07398 149.2
[M+HCOO]- 289.07492 175.5
[M+CH3COO]- 303.09057 196.0
[M+Na-2H]- 265.05139 159.1
[M]+ 244.07617 153.0
[M]- 244.07727 153.0
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.