CID 295642

1-[2-(1h-indol-3-yl)ethyl]pyrrolidin-2-one

Structural Information

Molecular Formula
C14H16N2O
SMILES
C1CC(=O)N(C1)CCC2=CNC3=CC=CC=C32
InChI
InChI=1S/C14H16N2O/c17-14-6-3-8-16(14)9-7-11-10-15-13-5-2-1-4-12(11)13/h1-2,4-5,10,15H,3,6-9H2
InChIKey
HUULIVDXAQTZEE-UHFFFAOYSA-N
Compound name
1-[2-(1H-indol-3-yl)ethyl]pyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

228.12627 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.13355 152.2
[M+Na]+ 251.11549 164.5
[M+NH4]+ 246.16009 160.7
[M+K]+ 267.08943 160.8
[M-H]- 227.11899 154.6
[M+Na-2H]- 249.10094 158.1
[M]+ 228.12572 154.5
[M]- 228.12682 154.5
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