CID 24212803

853331-38-1

Structural Information

Molecular Formula
C18H13Cl2NO2
SMILES
CC1=C(C=CC(=C1)Cl)NC(=O)C2=CC=C(O2)C3=CC=CC=C3Cl
InChI
InChI=1S/C18H13Cl2NO2/c1-11-10-12(19)6-7-15(11)21-18(22)17-9-8-16(23-17)13-4-2-3-5-14(13)20/h2-10H,1H3,(H,21,22)
InChIKey
RFOZNWQYHNUUAE-UHFFFAOYSA-N
Compound name
N-(4-chloro-2-methylphenyl)-5-(2-chlorophenyl)furan-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

345.03235 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 346.03963 180.6
[M+Na]+ 368.02157 190.7
[M-H]- 344.02507 191.0
[M+NH4]+ 363.06617 195.5
[M+K]+ 383.99551 184.5
[M+H-H2O]+ 328.02961 173.8
[M+HCOO]- 390.03055 195.5
[M+CH3COO]- 404.04620 192.5
[M+Na-2H]- 366.00702 181.7
[M]+ 345.03180 186.0
[M]- 345.03290 186.0
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.