CID 213622

Benzamide, n-(1-(2-(1h-indol-3-yl)ethyl)-4-piperidinyl)-4-methoxy-, monohydrochloride, hydrate

Structural Information

Molecular Formula
C23H27N3O2
SMILES
COC1=CC=C(C=C1)C(=O)NC2CCN(CC2)CCC3=CNC4=CC=CC=C43
InChI
InChI=1S/C23H27N3O2/c1-28-20-8-6-17(7-9-20)23(27)25-19-11-14-26(15-12-19)13-10-18-16-24-22-5-3-2-4-21(18)22/h2-9,16,19,24H,10-15H2,1H3,(H,25,27)
InChIKey
BYLGNVYODYXZFP-UHFFFAOYSA-N
Compound name
N-[1-[2-(1H-indol-3-yl)ethyl]piperidin-4-yl]-4-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

377.21033 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.21761 190.9
[M+Na]+ 400.19955 195.1
[M-H]- 376.20305 196.7
[M+NH4]+ 395.24415 201.1
[M+K]+ 416.17349 188.4
[M+H-H2O]+ 360.20759 180.1
[M+HCOO]- 422.20853 207.5
[M+CH3COO]- 436.22418 198.8
[M+Na-2H]- 398.18500 191.8
[M]+ 377.20978 188.1
[M]- 377.21088 188.1
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