CID 36438

Brn 0503181

Structural Information

Molecular Formula
C26H28ClN3O
SMILES
CN(C)CCC1(C2=CC=CC=C2N(C1=O)N(C)CC3=CC=C(C=C3)Cl)C4=CC=CC=C4
InChI
InChI=1S/C26H28ClN3O/c1-28(2)18-17-26(21-9-5-4-6-10-21)23-11-7-8-12-24(23)30(25(26)31)29(3)19-20-13-15-22(27)16-14-20/h4-16H,17-19H2,1-3H3
InChIKey
ZXIGBGZXNGBWJY-UHFFFAOYSA-N
Compound name
1-[(4-chlorophenyl)methyl-methylamino]-3-[2-(dimethylamino)ethyl]-3-phenylindol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

433.19208 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 434.19936 206.6
[M+Na]+ 456.18130 221.6
[M+NH4]+ 451.22590 216.7
[M+K]+ 472.15524 211.2
[M-H]- 432.18480 214.9
[M+Na-2H]- 454.16675 217.3
[M]+ 433.19153 211.7
[M]- 433.19263 211.7
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.