CID 111286

(trans)-n,n'-bis(2-chlorobenzylidene)-1,4-cyclohexanebis(methylamine) dihydrochloride

Structural Information

Molecular Formula
C22H24Cl2N2
SMILES
C1CC(CCC1CN=CC2=CC=CC=C2Cl)CN=CC3=CC=CC=C3Cl
InChI
InChI=1S/C22H24Cl2N2/c23-21-7-3-1-5-19(21)15-25-13-17-9-11-18(12-10-17)14-26-16-20-6-2-4-8-22(20)24/h1-8,15-18H,9-14H2
InChIKey
UMXZABWRYJGQFD-UHFFFAOYSA-N
Compound name
1-(2-chlorophenyl)-N-[[4-[[(2-chlorophenyl)methylideneamino]methyl]cyclohexyl]methyl]methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

386.13165 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 387.13893 196.3
[M+Na]+ 409.12087 201.6
[M-H]- 385.12437 205.8
[M+NH4]+ 404.16547 209.5
[M+K]+ 425.09481 193.2
[M+H-H2O]+ 369.12891 186.7
[M+HCOO]- 431.12985 210.5
[M+CH3COO]- 445.14550 225.6
[M+Na-2H]- 407.10632 197.1
[M]+ 386.13110 196.9
[M]- 386.13220 196.9
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.