CID 213647

Brn 0444705

Structural Information

Molecular Formula
C22H23N3O2
SMILES
C1CN(CCC1NC(=O)C2=CC=CC=C2)CC(=O)C3=CNC4=CC=CC=C43
InChI
InChI=1S/C22H23N3O2/c26-21(19-14-23-20-9-5-4-8-18(19)20)15-25-12-10-17(11-13-25)24-22(27)16-6-2-1-3-7-16/h1-9,14,17,23H,10-13,15H2,(H,24,27)
InChIKey
QDEJBGVHAUMUFK-UHFFFAOYSA-N
Compound name
N-[1-[2-(1H-indol-3-yl)-2-oxoethyl]piperidin-4-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

361.17902 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 362.18630 187.3
[M+Na]+ 384.16824 199.5
[M+NH4]+ 379.21284 194.2
[M+K]+ 400.14218 193.9
[M-H]- 360.17174 192.1
[M+Na-2H]- 382.15369 194.7
[M]+ 361.17847 190.2
[M]- 361.17957 190.2
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

patents stripe