CID 135612699

133405-35-3

Structural Information

Molecular Formula
C32H27N3O
SMILES
CN(C)C1=CC=C(C=C1)/C=C/C(=O)C2=CC=CC=C2N=CC3=C(NC4=CC=CC=C43)C5=CC=CC=C5
InChI
InChI=1S/C32H27N3O/c1-35(2)25-19-16-23(17-20-25)18-21-31(36)27-13-7-8-14-29(27)33-22-28-26-12-6-9-15-30(26)34-32(28)24-10-4-3-5-11-24/h3-22,34H,1-2H3/b21-18+,33-22?
InChIKey
QANOSCYIDPUJMO-CJKLDRCHSA-N
Compound name
(E)-3-[4-(dimethylamino)phenyl]-1-[2-[(2-phenyl-1H-indol-3-yl)methylideneamino]phenyl]prop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

469.21542 Da
Monoisotopic Mass

6.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 470.22270 220.4
[M+Na]+ 492.20464 237.2
[M+NH4]+ 487.24924 228.0
[M+K]+ 508.17858 227.3
[M-H]- 468.20814 230.6
[M+Na-2H]- 490.19009 232.6
[M]+ 469.21487 225.9
[M]- 469.21597 225.9
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.