CID 24212530

853311-65-6

Structural Information

Molecular Formula
C19H15Cl2NO2
SMILES
C1=CC(=CC(=C1)Cl)NC(=O)CCC2=CC=C(O2)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C19H15Cl2NO2/c20-14-6-4-13(5-7-14)18-10-8-17(24-18)9-11-19(23)22-16-3-1-2-15(21)12-16/h1-8,10,12H,9,11H2,(H,22,23)
InChIKey
XQPMDVKWOBQOJM-UHFFFAOYSA-N
Compound name
N-(3-chlorophenyl)-3-[5-(4-chlorophenyl)furan-2-yl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

359.04797 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 360.05525 185.2
[M+Na]+ 382.03719 194.0
[M-H]- 358.04069 194.9
[M+NH4]+ 377.08179 199.2
[M+K]+ 398.01113 187.4
[M+H-H2O]+ 342.04523 177.9
[M+HCOO]- 404.04617 199.7
[M+CH3COO]- 418.06182 196.2
[M+Na-2H]- 380.02264 186.4
[M]+ 359.04742 190.4
[M]- 359.04852 190.4
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.