CID 116779

70660-48-9

Structural Information

Molecular Formula
C20H24Cl2N2O2
SMILES
CCCCN(CCOC(=O)NC1=CC(=C(C=C1)Cl)Cl)C2=CC=CC(=C2)C
InChI
InChI=1S/C20H24Cl2N2O2/c1-3-4-10-24(17-7-5-6-15(2)13-17)11-12-26-20(25)23-16-8-9-18(21)19(22)14-16/h5-9,13-14H,3-4,10-12H2,1-2H3,(H,23,25)
InChIKey
IBUXMXQANREFOV-UHFFFAOYSA-N
Compound name
2-(N-butyl-3-methylanilino)ethyl N-(3,4-dichlorophenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

394.1215 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 395.12878 193.9
[M+Na]+ 417.11072 207.5
[M+NH4]+ 412.15532 201.5
[M+K]+ 433.08466 198.2
[M-H]- 393.11422 199.0
[M+Na-2H]- 415.09617 201.4
[M]+ 394.12095 197.9
[M]- 394.12205 197.9
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.