CID 3106354

Dtxsid901040810

Structural Information

Molecular Formula
C25H20N4O3
SMILES
C1=CC=C(C=C1)C(=O)C(NC2=CC=C(C=C2)N=NC3=CC=CC=C3)NC(=O)C4=CC=CO4
InChI
InChI=1S/C25H20N4O3/c30-23(18-8-3-1-4-9-18)24(27-25(31)22-12-7-17-32-22)26-19-13-15-21(16-14-19)29-28-20-10-5-2-6-11-20/h1-17,24,26H,(H,27,31)
InChIKey
WEGBNVJTBUUKNO-UHFFFAOYSA-N
Compound name
N-[2-oxo-2-phenyl-1-(4-phenyldiazenylanilino)ethyl]furan-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

424.15353 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 425.16081 200.5
[M+Na]+ 447.14275 202.5
[M-H]- 423.14625 215.7
[M+NH4]+ 442.18735 208.8
[M+K]+ 463.11669 200.1
[M+H-H2O]+ 407.15079 188.7
[M+HCOO]- 469.15173 228.4
[M+CH3COO]- 483.16738 238.0
[M+Na-2H]- 445.12820 204.6
[M]+ 424.15298 200.9
[M]- 424.15408 200.9
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.