CID 2750496

4',4'''-vinylenedibenzanilide

Structural Information

Molecular Formula
C28H22N2O2
SMILES
C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C=CC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4
InChI
InChI=1S/C28H22N2O2/c31-27(23-7-3-1-4-8-23)29-25-17-13-21(14-18-25)11-12-22-15-19-26(20-16-22)30-28(32)24-9-5-2-6-10-24/h1-20H,(H,29,31)(H,30,32)
InChIKey
OLWMSXPKBVMLAD-UHFFFAOYSA-N
Compound name
N-[4-[2-(4-benzamidophenyl)ethenyl]phenyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

418.16812 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 419.17540 203.2
[M+Na]+ 441.15734 206.2
[M-H]- 417.16084 214.5
[M+NH4]+ 436.20194 210.9
[M+K]+ 457.13128 198.9
[M+H-H2O]+ 401.16538 191.3
[M+HCOO]- 463.16632 225.8
[M+CH3COO]- 477.18197 211.0
[M+Na-2H]- 439.14279 205.8
[M]+ 418.16757 200.0
[M]- 418.16867 200.0
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

patents stripe