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]+ 338.18630 178.3
[M+Na]+ 360.16824 183.0
[M-H]- 336.17174 185.3
[M+NH4]+ 355.21284 190.7
[M+K]+ 376.14218 178.4
[M+H-H2O]+ 320.17628 169.1
[M+HCOO]- 382.17722 196.1
[M+CH3COO]- 396.19287 187.7
[M+Na-2H]- 358.15369 179.0
[M]+ 337.17847 175.8
[M]- 337.17957 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.