CID 209660

P-toluidine, 5-chloro-3-(p-chlorophenyl)-n-(2-(diethylamino)ethyl)-, oxalate

Structural Information

Molecular Formula
C19H24Cl2N2
SMILES
CCN(CC)CCNC1=CC(=C(C(=C1)Cl)C)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C19H24Cl2N2/c1-4-23(5-2)11-10-22-17-12-18(14(3)19(21)13-17)15-6-8-16(20)9-7-15/h6-9,12-13,22H,4-5,10-11H2,1-3H3
InChIKey
SUORSNPBRBIOET-UHFFFAOYSA-N
Compound name
N-[3-chloro-5-(4-chlorophenyl)-4-methylphenyl]-N',N'-diethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.13165 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.13893 185.1
[M+Na]+ 373.12087 200.5
[M+NH4]+ 368.16547 194.4
[M+K]+ 389.09481 189.8
[M-H]- 349.12437 191.7
[M+Na-2H]- 371.10632 193.9
[M]+ 350.13110 190.0
[M]- 350.13220 190.0
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.