CID 213630

Brn 0496060

Structural Information

Molecular Formula
C20H23N3O2
SMILES
C1CN(CCC1NC(=O)C2=CC=CO2)CCC3=CNC4=CC=CC=C43
InChI
InChI=1S/C20H23N3O2/c24-20(19-6-3-13-25-19)22-16-8-11-23(12-9-16)10-7-15-14-21-18-5-2-1-4-17(15)18/h1-6,13-14,16,21H,7-12H2,(H,22,24)
InChIKey
ZGHFLIZIXZJZBN-UHFFFAOYSA-N
Compound name
N-[1-[2-(1H-indol-3-yl)ethyl]piperidin-4-yl]furan-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.17902 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.186296 178.3
[M+Na]+ 360.168238 183.0
[M-H]- 336.171744 185.3
[M+NH4]+ 355.212843 190.7
[M+K]+ 376.142178 178.4
[M+H-H2O]+ 320.176280 169.1
[M+HCOO]- 382.177221 196.1
[M+CH3COO]- 396.192871 187.7
[M+Na-2H]- 358.153686 179.0
[M]+ 337.17847142 175.8
[M]- 337.17956858 175.8
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.