CID 2386166

N,n'-bis(5-chloro-2-methoxyphenyl)propanediamide

Structural Information

Molecular Formula
C17H16Cl2N2O4
SMILES
COC1=C(C=C(C=C1)Cl)NC(=O)CC(=O)NC2=C(C=CC(=C2)Cl)OC
InChI
InChI=1S/C17H16Cl2N2O4/c1-24-14-5-3-10(18)7-12(14)20-16(22)9-17(23)21-13-8-11(19)4-6-15(13)25-2/h3-8H,9H2,1-2H3,(H,20,22)(H,21,23)
InChIKey
RLYMXOOGAFQPJB-UHFFFAOYSA-N
Compound name
N,N'-bis(5-chloro-2-methoxyphenyl)propanediamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

27
Patents

382.0487 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.05598 184.6
[M+Na]+ 405.03792 197.6
[M+NH4]+ 400.08252 190.9
[M+K]+ 421.01186 190.6
[M-H]- 381.04142 188.1
[M+Na-2H]- 403.02337 191.1
[M]+ 382.04815 187.9
[M]- 382.04925 187.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe