CID 1327627

433970-86-6

Structural Information

Molecular Formula
C18H13Cl2NO3
SMILES
COC1=C(C=C(C=C1)Cl)NC(=O)C2=CC=C(O2)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C18H13Cl2NO3/c1-23-16-7-6-13(20)10-14(16)21-18(22)17-9-8-15(24-17)11-2-4-12(19)5-3-11/h2-10H,1H3,(H,21,22)
InChIKey
FFCIKQUFXFLPNU-UHFFFAOYSA-N
Compound name
N-(5-chloro-2-methoxyphenyl)-5-(4-chlorophenyl)furan-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

361.02725 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 362.03453 183.0
[M+Na]+ 384.01647 192.9
[M-H]- 360.01997 193.5
[M+NH4]+ 379.06107 197.2
[M+K]+ 399.99041 187.5
[M+H-H2O]+ 344.02451 176.1
[M+HCOO]- 406.02545 198.2
[M+CH3COO]- 420.04110 194.7
[M+Na-2H]- 382.00192 184.2
[M]+ 361.02670 189.8
[M]- 361.02780 189.8
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.