CID 9044803

950034-18-1

Structural Information

Molecular Formula
C23H25N3O3
SMILES
CN(CC(=O)C1=C(NC2=CC=CC=C21)C3=CC=CC=C3)CC(=O)N4CCOCC4
InChI
InChI=1S/C23H25N3O3/c1-25(16-21(28)26-11-13-29-14-12-26)15-20(27)22-18-9-5-6-10-19(18)24-23(22)17-7-3-2-4-8-17/h2-10,24H,11-16H2,1H3
InChIKey
FRUZIJBUVKTDFU-UHFFFAOYSA-N
Compound name
2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-1-(2-phenyl-1H-indol-3-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2
Patents

391.1896 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 392.19688 193.8
[M+Na]+ 414.17882 197.1
[M-H]- 390.18232 201.4
[M+NH4]+ 409.22342 202.1
[M+K]+ 430.15276 193.4
[M+H-H2O]+ 374.18686 182.9
[M+HCOO]- 436.18780 209.3
[M+CH3COO]- 450.20345 201.7
[M+Na-2H]- 412.16427 194.0
[M]+ 391.18905 192.5
[M]- 391.19015 192.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe