CID 211762

23564-77-4

Structural Information

Molecular Formula
C14H12Cl2N2
SMILES
CC1=C(C=C(C=C1)N=C(C2=CC=CC=C2Cl)N)Cl
InChI
InChI=1S/C14H12Cl2N2/c1-9-6-7-10(8-13(9)16)18-14(17)11-4-2-3-5-12(11)15/h2-8H,1H3,(H2,17,18)
InChIKey
QBLVLEGTQGQSTE-UHFFFAOYSA-N
Compound name
2-chloro-N'-(3-chloro-4-methylphenyl)benzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.03775 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.04503 162.2
[M+Na]+ 301.02697 171.7
[M-H]- 277.03047 169.3
[M+NH4]+ 296.07157 179.7
[M+K]+ 317.00091 164.9
[M+H-H2O]+ 261.03501 156.2
[M+HCOO]- 323.03595 179.0
[M+CH3COO]- 337.05160 204.5
[M+Na-2H]- 299.01242 165.5
[M]+ 278.03720 164.2
[M]- 278.03830 164.2
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.