CID 13089609

3-(piperidin-4-yl)-2,3-dihydro-1h-indol-2-one hydrochloride

Structural Information

Molecular Formula
C13H16N2O
SMILES
C1CNCCC1C2C3=CC=CC=C3NC2=O
InChI
InChI=1S/C13H16N2O/c16-13-12(9-5-7-14-8-6-9)10-3-1-2-4-11(10)15-13/h1-4,9,12,14H,5-8H2,(H,15,16)
InChIKey
AQEMSEIARDSIFX-UHFFFAOYSA-N
Compound name
3-piperidin-4-yl-1,3-dihydroindol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

216.12627 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.133546 149.9
[M+Na]+ 239.115488 155.5
[M-H]- 215.118994 151.2
[M+NH4]+ 234.160093 166.8
[M+K]+ 255.089428 149.9
[M+H-H2O]+ 199.123530 142.1
[M+HCOO]- 261.124471 164.2
[M+CH3COO]- 275.140121 160.0
[M+Na-2H]- 237.100936 152.3
[M]+ 216.12572142 141.3
[M]- 216.12681858 141.3
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