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

3
Patents

418.16812 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 419.175396 203.2
[M+Na]+ 441.157338 206.2
[M-H]- 417.160844 214.5
[M+NH4]+ 436.201943 210.9
[M+K]+ 457.131278 198.9
[M+H-H2O]+ 401.165380 191.3
[M+HCOO]- 463.166321 225.8
[M+CH3COO]- 477.181971 211.0
[M+Na-2H]- 439.142786 205.8
[M]+ 418.16757142 200.0
[M]- 418.16866858 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