CID 1858160

72833-08-0

Structural Information

Molecular Formula
C23H20N2O2
SMILES
CC1=CC=C(C=C1)NC(=O)/C(=C\C2=CC=CC=C2)/NC(=O)C3=CC=CC=C3
InChI
InChI=1S/C23H20N2O2/c1-17-12-14-20(15-13-17)24-23(27)21(16-18-8-4-2-5-9-18)25-22(26)19-10-6-3-7-11-19/h2-16H,1H3,(H,24,27)(H,25,26)/b21-16+
InChIKey
PCDMWCUBLKTOTO-LTGZKZEYSA-N
Compound name
N-[(E)-3-(4-methylanilino)-3-oxo-1-phenylprop-1-en-2-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

356.15247 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.159746 186.8
[M+Na]+ 379.141688 189.8
[M-H]- 355.145194 195.5
[M+NH4]+ 374.186293 197.5
[M+K]+ 395.115628 184.3
[M+H-H2O]+ 339.149730 176.6
[M+HCOO]- 401.150671 209.3
[M+CH3COO]- 415.166321 218.4
[M+Na-2H]- 377.127136 189.1
[M]+ 356.15192142 183.8
[M]- 356.15301858 183.8
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.