CID 45051012

853348-14-8

Structural Information

Molecular Formula
C19H13Cl2NO2
SMILES
C1=CC=C(C(=C1)C2=CC=C(O2)/C=C/C(=O)NC3=CC=CC=C3Cl)Cl
InChI
InChI=1S/C19H13Cl2NO2/c20-15-6-2-1-5-14(15)18-11-9-13(24-18)10-12-19(23)22-17-8-4-3-7-16(17)21/h1-12H,(H,22,23)/b12-10+
InChIKey
MIGLOBDZKKYFQI-ZRDIBKRKSA-N
Compound name
(E)-N-(2-chlorophenyl)-3-[5-(2-chlorophenyl)furan-2-yl]prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

357.03235 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.03963 182.7
[M+Na]+ 380.02157 198.9
[M+NH4]+ 375.06617 191.3
[M+K]+ 395.99551 190.8
[M-H]- 356.02507 190.2
[M+Na-2H]- 378.00702 191.9
[M]+ 357.03180 187.9
[M]- 357.03290 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.