CID 3520009

N-(cinnamylidene)-2,4-dichloroaniline

Structural Information

Molecular Formula
C15H11Cl2N
SMILES
C1=CC=C(C=C1)C=CC=NC2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C15H11Cl2N/c16-13-8-9-15(14(17)11-13)18-10-4-7-12-5-2-1-3-6-12/h1-11H
InChIKey
JRQNHNAYVXGQBB-UHFFFAOYSA-N
Compound name
N-(2,4-dichlorophenyl)-3-phenylprop-2-en-1-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.02686 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.03414 160.8
[M+Na]+ 298.01608 170.5
[M-H]- 274.01958 167.8
[M+NH4]+ 293.06068 178.8
[M+K]+ 313.99002 162.6
[M+H-H2O]+ 258.02412 154.4
[M+HCOO]- 320.02506 177.9
[M+CH3COO]- 334.04071 199.9
[M+Na-2H]- 296.00153 166.1
[M]+ 275.02631 164.0
[M]- 275.02741 164.0
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.