CID 1378972

Cbmicro_013700

Structural Information

Molecular Formula
C22H16N2O5
SMILES
C1=COC(=C1)C(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)NC(=O)C4=CC=CO4
InChI
InChI=1S/C22H16N2O5/c25-21(19-3-1-13-27-19)23-15-5-9-17(10-6-15)29-18-11-7-16(8-12-18)24-22(26)20-4-2-14-28-20/h1-14H,(H,23,25)(H,24,26)
InChIKey
LVUJQRSQZSJRRZ-UHFFFAOYSA-N
Compound name
N-[4-[4-(furan-2-carbonylamino)phenoxy]phenyl]furan-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

9
Patents

388.10593 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.11321 188.9
[M+Na]+ 411.09515 194.7
[M-H]- 387.09865 204.1
[M+NH4]+ 406.13975 199.3
[M+K]+ 427.06909 193.7
[M+H-H2O]+ 371.10319 180.4
[M+HCOO]- 433.10413 215.4
[M+CH3COO]- 447.11978 200.3
[M+Na-2H]- 409.08060 191.8
[M]+ 388.10538 193.5
[M]- 388.10648 193.5
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