CID 6448454

Brn 5448633

Structural Information

Molecular Formula
C24H20N2O
SMILES
CC1=C(N(C2=CC=CC=C12)C3=CC=CC=C3)NC(=O)/C=C/C4=CC=CC=C4
InChI
InChI=1S/C24H20N2O/c1-18-21-14-8-9-15-22(21)26(20-12-6-3-7-13-20)24(18)25-23(27)17-16-19-10-4-2-5-11-19/h2-17H,1H3,(H,25,27)/b17-16+
InChIKey
INUSSNDCTRJFNE-WUKNDPDISA-N
Compound name
(E)-N-(3-methyl-1-phenylindol-2-yl)-3-phenylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

352.15756 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.16484 186.4
[M+Na]+ 375.14678 194.3
[M-H]- 351.15028 196.0
[M+NH4]+ 370.19138 200.0
[M+K]+ 391.12072 186.5
[M+H-H2O]+ 335.15482 176.3
[M+HCOO]- 397.15576 209.7
[M+CH3COO]- 411.17141 197.0
[M+Na-2H]- 373.13223 189.7
[M]+ 352.15701 187.3
[M]- 352.15811 187.3
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

No patent data available for this compound.