CID 11338599

Schembl12167627

Structural Information

Molecular Formula
C23H18N2O5
SMILES
C1=CC(=CC(=C1)OC2=CC=C(C=C2)NC(=O)C3=CC=CO3)CNC(=O)C4=CC=CO4
InChI
InChI=1S/C23H18N2O5/c26-22(20-6-2-12-28-20)24-15-16-4-1-5-19(14-16)30-18-10-8-17(9-11-18)25-23(27)21-7-3-13-29-21/h1-14H,15H2,(H,24,26)(H,25,27)
InChIKey
DXDLWAKPUXQVJF-UHFFFAOYSA-N
Compound name
N-[[3-[4-(furan-2-carbonylamino)phenoxy]phenyl]methyl]furan-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

402.12158 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 403.12886 193.4
[M+Na]+ 425.11080 198.8
[M-H]- 401.11430 208.4
[M+NH4]+ 420.15540 203.3
[M+K]+ 441.08474 197.5
[M+H-H2O]+ 385.11884 184.7
[M+HCOO]- 447.11978 219.6
[M+CH3COO]- 461.13543 204.4
[M+Na-2H]- 423.09625 195.8
[M]+ 402.12103 198.3
[M]- 402.12213 198.3
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

patents stripe